Silica gel column chromatography(CC),Sephadex LH-20 CC and high performance liquid chromatography(HPLC)were used to study the chemical constituents of the fruits of the medicine-food plant Rubus idaeus Linnaeus.A new ...Silica gel column chromatography(CC),Sephadex LH-20 CC and high performance liquid chromatography(HPLC)were used to study the chemical constituents of the fruits of the medicine-food plant Rubus idaeus Linnaeus.A new tetrahydrogenated naphthol syringic acid ester,named rubusnolicester(1),two new phenolic glycoside derivatives,4-chloro-2,6-dimethoxylphenol-1-O-β-D-glucopyranoside(2)and salicylic acid-2-O-(6'-O-acetyl)-β-D-glucopyranoside(3),together with one known salicylic acid glycoside derivative(4)and three known flavonoids derivatives(5~7),were isolated.Their structures were elucidated by HRESI-MS,NMR spectroscopy,and a comparison of optical rotation(OR).Compounds 1~7 were evaluated the inhibitory activities against the nitric oxide(NO)production induced by lipopolysaccharide(LPS)in mouse macrophage RAW264.7 cells in vitro.Compound 1 exhibited inhibitory effect with the IC50 value of(12.28±1.25)μmol/L.展开更多
The efficient mineralization of phenol and its derivatives in wastewater remains a great challenge.In this study,the bimetallic CuCeO_(2)-BTC was screened from a series of MOFs-derived MCeO_(2)-BTC(M=La,Cu,Co,Fe,and M...The efficient mineralization of phenol and its derivatives in wastewater remains a great challenge.In this study,the bimetallic CuCeO_(2)-BTC was screened from a series of MOFs-derived MCeO_(2)-BTC(M=La,Cu,Co,Fe,and Mn)catalysts,and the influence of the Cu/Ce ratio on phenol removal by catalytic ozonation was carefully examined.The results indicate that Cu_(2)Ce_(1)O_(y)-BTC was the best among the Cu_(x)Ce_(1)O_(y)-BTC(x=0,1,2,and 3)catalysts,with a phenol mineralization efficiency reaching close to 100%within 200 min,approximately 30.1%higher than CeO_(2)-BTC/O_(3)and 70.3%higher than O_(3)alone.The order of mineralization efficiency of phenol was Cu_(2)Ce_(1)O_(y)-BTC>Cu_(3)Ce_(1)O_(y)-BTC>Cu_(1)Ce_(1)O_(y)-BTC>CeO_(2)-BTC.CeO_(2)-BTC exhibited a broccoli-like morphology,and Cu_(x)Ce_(1)O_(y)-BTC(x=1,2,and 3)exhibited an urchin-like morphology.Compared with Cu_(x)Ce_(1)O_(y)-BTC(x=0,1,and 3),Cu_(2)Ce_(1)O_(y)-BTC exhibited a larger specific surface area and pore volume.This characteristic contributed to the availability of more active sites for phenol degradation.The redox ability was greatly enhanced as well.Besides,the surface of Cu_(2)Ce_(1)O_(y)-BTC exhibited a higher concentration of Ce^(3+)species and hydroxyl groups,which facilitated the dissociation of ozone and the generation of active radicals.Based on the results of radical quenching experiments and the intermediates detected by LC-MS,a potential mechanism for phenol degradation in the Cu_(2)Ce_(1)O_(y)-BTC/O_(3)system was postulated.This study offers novel perspectives on the advancement of MOFs-derived catalysts for achieving the complete mineralization of phenol in wastewater through catalytic ozonation.展开更多
Bio-oil is a renewable fuel that can be obtained from biomass waste,such as empty palm fruit bunches,sugarcane bagasse,and rice husks.Within a biorefinery framework,bio-oil had not met the standards as a fuel due to t...Bio-oil is a renewable fuel that can be obtained from biomass waste,such as empty palm fruit bunches,sugarcane bagasse,and rice husks.Within a biorefinery framework,bio-oil had not met the standards as a fuel due to the presence of impurities like corrosive phenol.Therefore,the separation of phenol from bio-oil is essential and can be achieved using the extraction method.In this study,biomass wastes(empty fruit bunches of oil palm,sugarcane bagasse,and rice husk)were pyrolyzed in a biorefinery framework to produce bio-oil,which was then refined through liquid-liquid extraction with a methanol-chloroform and ethyl acetate solvents to remove its phenolic compound.The extraction with methanol-chloroform solvent was carried out for 1 h at 50℃.Meanwhile,extraction with ethyl acetate solvent was carried out for 3 h at 70℃.Both extractions used the same variations,i.e.,bio-oil:solvent ratio at 1:1,1:2,1:3,and 1:4,and stirring speeds of 150 rpm,200 rpm,250 rpm,and 300 rpm.The bio-oil obtained from this study contained complex chemical compounds and had characteristics such as a pH of 5,a density of 1.116 g/mL,and a viscosity of 29.57 cSt.Theoptimization results using response surface methodology(RSM)showed that the best yield formethanolchloroform was 72.98%at a stirring speed of 250 rpm and a ratio of 1:3.As for ethyl acetate solvent,the highest yield obtained was 71.78%at a stirring speed of 237.145 rpm and a ratio of 1:2.展开更多
Prolonged lack of rain and high-temperature lead to soil water deficits,inhibiting cereal crop growth in early ontogenesis and reducing grain quality and yield.Rye(Secale cereale L.)is a key grain crop,particularly in...Prolonged lack of rain and high-temperature lead to soil water deficits,inhibiting cereal crop growth in early ontogenesis and reducing grain quality and yield.Rye(Secale cereale L.)is a key grain crop,particularly in regions where wheat cultivation is challenging or unfeasible.To clarify its drought adaptation mechanisms,we analyzed the effects of moderate soil drought on growth,hormonal homeostasis,and the dynamics and distribution of free amino acids and phenolic compounds in rye at early vegetative stages and post-recovery.Drought triggered both general and organ-specific changes in endogenous phytohormones.A nonspecific response involved the accumulation of stress hormones abscisic acid(ABA)and salicylic acid(SA),alongside the suppression of growth hormones indole-3-acetic acid(IAA)and gibberellins.However,hormone dynamics and localization varied across plant organs.ABA and SA levels significantly increased in shoots of drought-stressed and recovered plants,corresponding with inhibited growth.Prolonged drought further enhanced ABA accumulation in both shoots and roots of recovered plants,while SA levels declined in roots but remained elevated in shoots.Drought also caused a substantial reduction in IAA,particularly in shoots,while gibberellins(GA_(3)+GA_(4))significantly decreased in roots.GA_(3)was predominant in most samples,except in the shoots of 2-day-old control plants.Post-recovery,IAA levels increased but remained below control values,while GA_(4)accumulation in roots led to a rise in total gibberellin levels.In contrast,shoot GA_(3)+GA_(4)levels declined,primarily due to GA_(3)reduction.The dominant free amino acids:aspartic acid,glutamic acid,glycine,alanine,and leucinedecreased significantly,underscoring their key role in stress adaptation.Increased flavonoid accumulation,especially in roots,suggests their involvement in antioxidant defense against oxidative stress.A significant increase in ABA and SA levels,along with a marked reduction in IAA and GA content in stressed rye plants occurred alongside a reduction in free amino acid content,accumulation of phenolic compounds,and an increase in flavonoid levels.These findings indicate distinct adaptation strategies in rye shoots and roots undermoderate soil drought.They provide a foundation for further research on drought resistance mechanisms in cereals and the development of strategies to enhance their adaptive potential.展开更多
Phenol is extensively utilized in various industries involving paints,rubber,textiles,explosives,plastics,etc.Compared to the conventional distillation or extraction technologies,pervaporation(PV)membrane process can ...Phenol is extensively utilized in various industries involving paints,rubber,textiles,explosives,plastics,etc.Compared to the conventional distillation or extraction technologies,pervaporation(PV)membrane process can be operated at a low temperature and has a low energy consumption as well as a high separation efficiency for phenol recovery.Thus,to meet the high demand for phenol recovery,the application of PV has been encouraged,and reached a new level.The PV process is governed by the properties of the membrane materials that significantly influence the energy costs associated with the separation unit,and the membrane types include polymer membranes,inorganic membranes,and mixed matrix membranes.Although recent literatures show that PV membranes have been continuously updated,no review has reported the latest development about it.In this work,the material types,separation properties and preparation methods of hydrophobic PV membranes for phenol recovery are summarized.Furthermore,the key preparation methods and application challenges associated with membranes are summarized,along with an overview of the opportunities and challenges posed by hydrophobic PV membranes for phenol recovery.展开更多
Chrysanthemum morifolium Ramat.is an important industrial crop with a high medicinal value,whose capitulum consists of ray and disc florets containing numerous bioactive components,such as flavonoids and phenolic acid...Chrysanthemum morifolium Ramat.is an important industrial crop with a high medicinal value,whose capitulum consists of ray and disc florets containing numerous bioactive components,such as flavonoids and phenolic acids.However,the distribution and accumulations of the bioactive metabolites in florets of Chrysanthemum morifolium were unclear.Herein,the ray and disc florets of Chrysanthemum morifolium were separated for comparing the bioactive metabolites.The contents of phenolic compounds and antioxidant activities were significantly different between the two florets.The metabolomic analysis identified 203 and 241 differential metabolites between ray and disc florets at two flowering stages.The derivatives of quercetin,isorhamnetin,tricin,and caffeoylquinic acid were enriched in the disc florets,while apigenin,kaempferol,acacetin,and their glycosides mainly accumulated in the ray florets.Besides,the results of transcriptome and qRT-PCR suggested that the F3H,F3'H,and FLS genes highly expressed in disc florets,while the FNS gene was well expressed in ray florets,which explained the different distribution of phenolic compounds between ray and disc florets.Furthermore,the expression of CmCYC2 genes was found to be significantly related to the distribution of flavones by correlation analysis.It was proved by the luciferase reporter assay that CmCYC2a and CmCYC2d factors could bind and activate the CmFNS promoter to regulate the flavones biosynthesis in ray florets.These results revealed the significant difference of metabolite contents and gene expression profile between ray and disc floret in Chrysanthemum morifolium and demonstrated that the quality of Chrysanthemum morifolium‘Hangju'was closely relevant to its flower morphology.展开更多
Moringa oleifera Lam.is a Moringa genus in the Moringaceae family that is high in nutrients and has a wide range of applications.Phenolic compounds are widely found in plants and have various health benefits for the h...Moringa oleifera Lam.is a Moringa genus in the Moringaceae family that is high in nutrients and has a wide range of applications.Phenolic compounds are widely found in plants and have various health benefits for the human body.With its high content and wide variety of phenolic compounds,M.oleifera Lam.has been widely studied for its health benefits.The phenolic compounds in M.oleifera Lam.(MOPCs)can be a potential source of functional food ingredients in pharmaceutical and industrial applications.Numerous studies have shown that MOPCs have antioxidant,anti-obesity,anti-diabetic,and antibacterial effects.Although the research on MOPCs has been gradually increasing,the extraction,isolation,identification,biological activities,and comprehensive application of MOPCs need a more systematic summary and generalization.Therefore,this paper reviews the isolation and extraction methods,structure identification,biological activities,and comprehensive applications to provide a further reference for the research and application of MOPCs.展开更多
Synthetic phenolic antioxidants(SPAs)are widely used in diverse industries due to their exceptional antioxidant characteristics.However,human exposure to SPAs may cause health problems.In this study,226 dust samples w...Synthetic phenolic antioxidants(SPAs)are widely used in diverse industries due to their exceptional antioxidant characteristics.However,human exposure to SPAs may cause health problems.In this study,226 dust samples were collected from 10 provinces in China,and six SPAs(three parent SPAs and their three transformation products)were analyzed.The concentrations of6SPAs(the sum of six target compounds)ranged from 15.4 to 3210 ng/g(geometric mean(GM):169 ng/g).The highest concentration of6SPAswas found in Sichuan Province(GM:349 ng/g),which was approximately 4 times higher than that in Hubei Province(81.6 ng/g)(p<0.05).The concentrations of butylated hydroxytoluene(BHT),2,2'-methylene bis(4-methyl-6–tert-butylphenol)(AO2246),2,6-di–tert–butyl–1,4-benzoquinone(BHT-Q),2,6-di–tert–butyl–4-(hydroxymethyl)phenol(BHT-OH),and ∑_(p)-SPAs were substantially higher in dust from urban areas than rural areas(p<0.05).AO2246 concentration in dust from homes(GM:0.400 ng/g)was about 4 times higher than that in workplaces(0.116 ng/g)(p<0.01).Significantly higherp-SPAs concentrations were found in dust from homes(GM:17.5 ng/g)than workplaces(11.4 ng/g)(p<0.01).The estimated daily intakes(EDIs)of ∑_(6)SPAs exposed through dust ingestion were 0.582,0.342,0.197,0.076,and 0.080 ng/kg bw/day in different age groups,and exposed through dermal contact was 0.358,0.252,0.174,0.167,and 0.177 ng/kg bw/day.EDIs showed that the exposure risks of SPAs decreased with age.This is the first work to determine SPAs in dust from10 provinces in China and investigate the spatial distribution of SPAs in those regions.展开更多
The surface of MoSi2-SiB6/phenolic resin matrix composites was modified by mica,and the thermal oxidation behavior of the composites and the mechanical properties of the pyrolysis products were studied.The results sho...The surface of MoSi2-SiB6/phenolic resin matrix composites was modified by mica,and the thermal oxidation behavior of the composites and the mechanical properties of the pyrolysis products were studied.The results showed that the mica improved the thermal properties of the composites,the thermal expansion coefficient decreased,and the liquid phase formation caused the composites to shrink and increase the density.The flexural strength of mica surface modified composites not only increased to 78.64MPa after thermal treatment at 800-1200℃,but reached 83.02 MPa after high temperature treatment at1400℃.The improvement of the mechanical properties of the residual product benefits from the formation of high temperature ceramic phases such as Mo_(2)C and MoB,and the improvement of the shear strength of the composites by the mica.The shear strength of MBm5-2 at room temperature reached 33.08 MPa,indicating that the improvement of the interlayer properties of the composites further improved its mechanical properties.展开更多
In thermal protection structures,controlling and optimizing the surface roughness of carbon/phenolic(C/Ph)composites can effectively improve thermal protection performance and ensure the safe operation of carriers in ...In thermal protection structures,controlling and optimizing the surface roughness of carbon/phenolic(C/Ph)composites can effectively improve thermal protection performance and ensure the safe operation of carriers in high-temperature environments.This paper introduces a machine learning(ML)framework to forecast the surface roughness of carbon-phenolic composites under various thermal conditions by employing an ML algorithm derived from historical experimental datasets.Firstly,ablation experiments and collection of surface roughness height data of C/Ph composites under different thermal environments were conducted in an electric arc wind tunnel.Then,an ML model based on Ridge regression is developed for surface roughness prediction.The model involves incorporating feature engineering to choose the most concise and pertinent features,as well as developing an ML model.The ML model considers thermal environment parameters and feature screened by feature engineering as inputs,and predicts the surface height as the output.The results demonstrate that the suggested ML framework effectively anticipates the surface shape and associated surface roughness parameters in various heat flow conditions.Compared with the conventional 3D confocal microscope scanning,the method can obtain the surface topography information of the same area in a much shorter time,thus significantly saving time and cost.展开更多
Carbon fiber/phenolic resin composites have great potential application in the field of electronic information,where excellent structural-functional integration is required.In this work,the establishment of interfacia...Carbon fiber/phenolic resin composites have great potential application in the field of electronic information,where excellent structural-functional integration is required.In this work,the establishment of interfacial structures consisting of carbon nanotubes with different morphologies at the fiber/matrix interface is conducive to the further modulation of the mechanical,tribological,electromagnetic interference(EMI)shielding and thermal conductivity properties of carbon fiber/phenolic resin composites.Specially,array carbon nanotubes can deep into the resin matrix,effectively hindering crack extension,and constructing an electrically and thermally conductive network.Compared with the carbon fiber/phenolic composites,the tensile strength and modulus of elasticity(163.86±9.60 MPa,5.06±0.25 GPa)of the array carbon nanotubes reinforced carbon fiber/phenolic composites were enhanced by 57.09%and 22.22%.The average friction coefficient and wear rate(0.20±0.02,1.11×10^(-13)±0.13×10^(-13)m^(3)N^(−1)m^(−1))were reduced by 39.39%and 74.31%.EMI shielding effectiveness up to 40 dB in the X-band at 0.4 mm sample thickness,diffusion coefficient(0.39±0.003 mm^(2)/s)and thermal conductivity(0.54±0.004 W/(m K))were enhanced by up to 14.37%and 50.42%.This study reveals the beneficial effects of morphological changes of carbon nanotubes on the design of interfacial structure,proposes the reinforcement mechanism of array carbon nanotubes,and opens up the prospect of carbon fiber/phenolic composites for electronic applications.展开更多
A Ti_(3)SiC_(2)-modified high-silica oxygen/phenolic aerogel composite with excellent oxidation resistance and high-temperature performance was prepared.The experimental results show that the obtained composite has si...A Ti_(3)SiC_(2)-modified high-silica oxygen/phenolic aerogel composite with excellent oxidation resistance and high-temperature performance was prepared.The experimental results show that the obtained composite has significantly improved oxidation resistance.When the addition amount of Ti_(3)SiC_(2)is 75%,the carbonization volume shrinkage rate of the composite after aerobic static combustion is only 5.95%.At the same time,the LAR and MAR after 30 seconds of oxyacetylene ablation under a heat flux density of 1.5 MW/m2 are 0.0307 mm/s and 0.0149 g/s,respectively.The compressive strength after aerobic static combustion at 1000℃is up to 20.43%of that before aerobic static combustion,which is 1.99 times that of the unfilled material,significantly improving the high-temperature mechanical properties of the composite.展开更多
The widespread application of phenolic substances in the field of food,medicine and industry,is harmful to the environment and human health.Therefore,it is very important to develop a con-venient and effective method ...The widespread application of phenolic substances in the field of food,medicine and industry,is harmful to the environment and human health.Therefore,it is very important to develop a con-venient and effective method to detect and degrade phenolic compounds.Herein,we report a new keggin-type polyoxometallate-based metal-organic complex self-assembled under solvothermal condition,{[Cu(dap)(3-PA)]4(SiW_(12)O_(40))(H_(2)O)_(2)}·2H_(2)O(1,dap=1,2-diaminopropane,3-HPA=3-pyridineacrylic acid).1 shows an interesting 1D ladder-like structure.As a bifunctional catalyst,1 can be employed as a colori-metric sensor toward phenol with the relatively low detection limit(LOD)of 0.36μmol/L(S/N=3)in the wide range(0.001-0.1 mmol/L).The title colorimetric sensor is applied to determine phenol in various water environment with good recoveries ranging from 95%-105%.In addition,1 also exhibits excellent photocatalytic degradation toward phenol under visible light with the highest removal efficiency at 96%for 100 min and wide pH universality.The selectivity,stability and reliability of the detection of 1 towards phenol,as well as the detection for 4-chlorophenol,o-cresol,4-nitrophenol and phloroglucinol were stud-ied.Furthermore,the photocatalytic reaction kinetics and the mechanisms of photodegradation of phenol were also investigated in detail.展开更多
Polyphenols were obtained from the natural dried Lonicerae flos by ultrasound-assisted extraction with ethanol as the solvent.Single factor experiment and response surface methodology were employed to optimize the ext...Polyphenols were obtained from the natural dried Lonicerae flos by ultrasound-assisted extraction with ethanol as the solvent.Single factor experiment and response surface methodology were employed to optimize the extraction conditions.Ultra-performance liquid chromatrography(UPLC)-tandem mass spectrometry(MS/MS)was employed to identify polyphenols based on the plant widely targeted metabolomics database in a qualitative and quantitative manner.The results showed that the optimal extraction conditions for total phenols from Lonicerae flos were ultrasound-assisted extraction with a solid-to-liquid ratio of 10∶1 g/mL and 57%ethanol at 70 W and 60°C for 11 min.The yield of total phenols extracted under the optimal conditions reached 71.08 mg/g.The phenols in Lonicerae flos were mainly chlorogenic acid isomers,and the flavonoids were mainly nobiletin,galuteolin,and homoarbutin.展开更多
Quinoa is a good source of phenolics,which both exist as free and bound forms.In order to mark clear the characteristic free and bound phenolics in different quinoa samples,in this study,characteristic free and bound ...Quinoa is a good source of phenolics,which both exist as free and bound forms.In order to mark clear the characteristic free and bound phenolics in different quinoa samples,in this study,characteristic free and bound phenolics in three colored quinoas including WQ(white quinoa),RQ(red quinoa)and BQ(black quinoa)were investigated.Result showed a total of 14 phenolics both acted as free and bound form were analyzed in three colored quinoas(WQ,RQ and BQ).Gallic acid,vanillic acid,epicatechin,p-coumaric acid and quercetin existed both as free and bound forms were common phenolics in quinoas.The highest total free phenolics(238.10 mg/kg)and bound phenolics(3377.75 mg/kg)were presented in WQ and RQ,respectively.It indicated WQ and RQ were respectively good source of free and bound phenolics.Moreover,characteristic free and bound phenolics in three colored quinoas could be well analyzed by principal component analysis(PCA),indicating it was an effective and reliable method in distinguishing three colored quinoas based on their characteristic free and bound phenolics,respectively.展开更多
The virtual cocrystal screening approach based on molecular electrostatic potential surface(MEPS)maps is a fast and feasible computational method to estimate the probability of cocrystal formation by calculating the d...The virtual cocrystal screening approach based on molecular electrostatic potential surface(MEPS)maps is a fast and feasible computational method to estimate the probability of cocrystal formation by calculating the difference in the interaction site pairing energies of monomers and that of their assemblies prior to experimental screening.In this paper,we report 12 cocrystal forms of temozolomide with mono-,di-,and trihydroxy benzoic acids,namely,3-hydroxy-,2,4-dihydroxy-,2,5-dihydroxy-,2,6-dihydroxy-,3,4-dihydroxy-,and 3,4,5-trihydroxy-benzoic acids,as well as benzoic acid,as pharmaceutical coformers for the first time.10 single crystals out of the 12 cocrystal forms were obtained and unequivocally determined by single-crystal X-ray diffraction,which clarified spatial arrangements,molecular conformations,and supramolecular synthons.MEPS further gains some insights into the sites of hydrogen bonding interactions for exploring combination patterns in these assemblies.Modulated stability of TMZ was successfully achieved by cocrystallization with these acids.展开更多
Lignin is the most abundant naturally phenolic biomass,and the synthesis of high-performance renewable fuel from lignin has attracted significant attention.We propose the efficient synthesis of high-density fuels usin...Lignin is the most abundant naturally phenolic biomass,and the synthesis of high-performance renewable fuel from lignin has attracted significant attention.We propose the efficient synthesis of high-density fuels using simulated lignin cracked oil in tandem with hydroalkylation and deoxygenation reactions.First,we investigated the reaction pathway for the hydroalkylation of phenol,which competes with the hydrodeoxygenation form cyclohexane.And then,we investigated the effects of metal catalyst types,the loading amount of metallic,acid dosage,and reactant ratio on the reaction results.The phenol hydroalkylation and hydrodeoxygenation were balanced when 180℃ and 5 MPa H_(2)with the alkanes yield of 95%.By extending the substrate to other lignin-derived phenolics and simulated lignin cracked oil,we obtained the polycyclic alkane fuel with high density of 0.918 g·ml^(-1)and calorific value of41.2 MJ·L^(-1).Besides,the fuel has good low-temperature properties(viscosity of 9.3 mm^(2)·s^(-1)at 20℃ and freezing point below-55℃),which is expected to be used as jet fuel.This work provides a promising way for the easy and green production of high-density fuel directly from real lignin oil.展开更多
Chlorine content and position of chlorinated phenols have many significant effects on the reactivity of oxido-reduction. The effects of chlorine content and position of chlorinated phenols on their oxidation kinetics ...Chlorine content and position of chlorinated phenols have many significant effects on the reactivity of oxido-reduction. The effects of chlorine content and position of chlorinated phenols on their oxidation kinetics by potassium permanganate were evaluated through different kinetics studies. Since chlorine was an electron withdrawing atom, the substitution of chlorine on the aromatic ring decreased the oxidation rate constant by σ-electron withdrawing conductive effect. The substitution of chlorine at ortho or para position on the aromatic ring increased the oxidation rate constant by π-electron donating conjugative effect, and the conjugative effect could counteract the negative impact of the conductive effect to some extent. On the other hand, the substitution of chlorine at ortho position on the aromatic ring decreased the oxidation rate constant by steric hindrance effect. The oxidation rate constants of phenol and chlorinated phenols studied decreased as follow order: 4-chlorophenol>2,4-dichlorophenol>phenol>2,6-dichlorophenol.展开更多
The utilization of perovskite oxide materials as catalysts for the photodegradation of organic pollutants in water is a promising and rapidly advancing field.In this study,a series of La_(1−x)Ba_(x)CoO_(3)(x=0.2,0.3,0...The utilization of perovskite oxide materials as catalysts for the photodegradation of organic pollutants in water is a promising and rapidly advancing field.In this study,a series of La_(1−x)Ba_(x)CoO_(3)(x=0.2,0.3,0.4,0.5,0.6)catalysts with varying Ba doping ratios were synthesized using the citric acid complexation-hydrothermal synthesis combined method for the degradation of phenol under visible light irradiation.Among the synthesized catalysts,La_(0.5)Ba_(0.5)CoO_(3) exhibited the highest photocatalytic activity.In addition,the photocatalytic mechanism for La_(0.5)Ba_(0.5)CoO_(3) perovskite degradation of phenol was also discussed.The synthesized catalysts were characterized using XRD,SEM,FT-IR,XPS,MPMS and other characterization techniques.The results revealed that the diffraction peak intensity of La_(1−x)Ba_(x)CoO_(3) increased with higher Ba doping ratios,and the La_(0.4)Ba_(0.6)CoO_(3) exhibited the strongest diffraction peaks.The catalyst particle sizes ranged from 10 to 50 nm,and the specific surface area decreased with increasing Ba content.Additionally,the paramagnetic properties of La_(0.5)Ba_(0.5)CoO_(3) were similar to that of La_(0.4)Ba_(0.6)CoO_(3).The experimental results suggested that the incorporation of Ba could significantly improve the catalytic performance of La_(1−x)Ba_(x)CoO_(3) perovskites,promote electron transfer and favor to the generation of hydroxyl radicals(•OH),leading to the efficiently degradation of phenol.展开更多
Recent studies have highlighted the potential of plant extracts as therapeutic agents for managing oxidative stress and related disorders.This study aims to elucidate the phenolic composition and antioxidant propertie...Recent studies have highlighted the potential of plant extracts as therapeutic agents for managing oxidative stress and related disorders.This study aims to elucidate the phenolic composition and antioxidant properties of Gymnema sylvestre extracts.Ethanolic reflux extraction followed by column chromatography was employed to isolate phenolic compounds.The total phenolic and flavonoid contents were quantified using the Folin–Ciocalteu and aluminum chloride colorimetric methods,respectively.Antioxidant activities were assessed by DPPH,ABTS scavenging assays and the ferric reducing antioxidant power(FRAP)assay.High-Performance Liquid Chromatography(HPLC)with a C18 column and Thermo TSQ Quantum Access Max(LC-MS)were used to determine the levels of gymnemic acid and identify other potential phenolic compounds.The analysis revealed significant antioxidant activities in the fractions.Fraction A showed the highest DPPH and ABTS scavenging activities,and Fraction C demonstrated the highest ferric reducing power.LC-MS analysis identified several phenolic compounds,indicating that these are major contributors to the antioxidant efficacy of the extract.This study provides a detailed phenolic profile and confirms the strong antioxidant potential of Gymnema sylvestre leaf extract,supporting its therapeutic use and further investigation.展开更多
文摘Silica gel column chromatography(CC),Sephadex LH-20 CC and high performance liquid chromatography(HPLC)were used to study the chemical constituents of the fruits of the medicine-food plant Rubus idaeus Linnaeus.A new tetrahydrogenated naphthol syringic acid ester,named rubusnolicester(1),two new phenolic glycoside derivatives,4-chloro-2,6-dimethoxylphenol-1-O-β-D-glucopyranoside(2)and salicylic acid-2-O-(6'-O-acetyl)-β-D-glucopyranoside(3),together with one known salicylic acid glycoside derivative(4)and three known flavonoids derivatives(5~7),were isolated.Their structures were elucidated by HRESI-MS,NMR spectroscopy,and a comparison of optical rotation(OR).Compounds 1~7 were evaluated the inhibitory activities against the nitric oxide(NO)production induced by lipopolysaccharide(LPS)in mouse macrophage RAW264.7 cells in vitro.Compound 1 exhibited inhibitory effect with the IC50 value of(12.28±1.25)μmol/L.
基金supported by the National Natural Science Foundation of China(No.22206013).
文摘The efficient mineralization of phenol and its derivatives in wastewater remains a great challenge.In this study,the bimetallic CuCeO_(2)-BTC was screened from a series of MOFs-derived MCeO_(2)-BTC(M=La,Cu,Co,Fe,and Mn)catalysts,and the influence of the Cu/Ce ratio on phenol removal by catalytic ozonation was carefully examined.The results indicate that Cu_(2)Ce_(1)O_(y)-BTC was the best among the Cu_(x)Ce_(1)O_(y)-BTC(x=0,1,2,and 3)catalysts,with a phenol mineralization efficiency reaching close to 100%within 200 min,approximately 30.1%higher than CeO_(2)-BTC/O_(3)and 70.3%higher than O_(3)alone.The order of mineralization efficiency of phenol was Cu_(2)Ce_(1)O_(y)-BTC>Cu_(3)Ce_(1)O_(y)-BTC>Cu_(1)Ce_(1)O_(y)-BTC>CeO_(2)-BTC.CeO_(2)-BTC exhibited a broccoli-like morphology,and Cu_(x)Ce_(1)O_(y)-BTC(x=1,2,and 3)exhibited an urchin-like morphology.Compared with Cu_(x)Ce_(1)O_(y)-BTC(x=0,1,and 3),Cu_(2)Ce_(1)O_(y)-BTC exhibited a larger specific surface area and pore volume.This characteristic contributed to the availability of more active sites for phenol degradation.The redox ability was greatly enhanced as well.Besides,the surface of Cu_(2)Ce_(1)O_(y)-BTC exhibited a higher concentration of Ce^(3+)species and hydroxyl groups,which facilitated the dissociation of ozone and the generation of active radicals.Based on the results of radical quenching experiments and the intermediates detected by LC-MS,a potential mechanism for phenol degradation in the Cu_(2)Ce_(1)O_(y)-BTC/O_(3)system was postulated.This study offers novel perspectives on the advancement of MOFs-derived catalysts for achieving the complete mineralization of phenol in wastewater through catalytic ozonation.
基金supported by theUniversitasNegeri Semarang throughDPAUNNES 2024The grant number is No.271.26.2/UN37/PPK.10/2024.
文摘Bio-oil is a renewable fuel that can be obtained from biomass waste,such as empty palm fruit bunches,sugarcane bagasse,and rice husks.Within a biorefinery framework,bio-oil had not met the standards as a fuel due to the presence of impurities like corrosive phenol.Therefore,the separation of phenol from bio-oil is essential and can be achieved using the extraction method.In this study,biomass wastes(empty fruit bunches of oil palm,sugarcane bagasse,and rice husk)were pyrolyzed in a biorefinery framework to produce bio-oil,which was then refined through liquid-liquid extraction with a methanol-chloroform and ethyl acetate solvents to remove its phenolic compound.The extraction with methanol-chloroform solvent was carried out for 1 h at 50℃.Meanwhile,extraction with ethyl acetate solvent was carried out for 3 h at 70℃.Both extractions used the same variations,i.e.,bio-oil:solvent ratio at 1:1,1:2,1:3,and 1:4,and stirring speeds of 150 rpm,200 rpm,250 rpm,and 300 rpm.The bio-oil obtained from this study contained complex chemical compounds and had characteristics such as a pH of 5,a density of 1.116 g/mL,and a viscosity of 29.57 cSt.Theoptimization results using response surface methodology(RSM)showed that the best yield formethanolchloroform was 72.98%at a stirring speed of 250 rpm and a ratio of 1:3.As for ethyl acetate solvent,the highest yield obtained was 71.78%at a stirring speed of 237.145 rpm and a ratio of 1:2.
基金This publication presents findings from research conducted under Project No.III-99-24.489Natural Growth Regulators in the Induction of Resistance of Cereal Plants to HeavyMetals(2024-2028)funded by the NationalAcademy of Sciences of Ukraine.
文摘Prolonged lack of rain and high-temperature lead to soil water deficits,inhibiting cereal crop growth in early ontogenesis and reducing grain quality and yield.Rye(Secale cereale L.)is a key grain crop,particularly in regions where wheat cultivation is challenging or unfeasible.To clarify its drought adaptation mechanisms,we analyzed the effects of moderate soil drought on growth,hormonal homeostasis,and the dynamics and distribution of free amino acids and phenolic compounds in rye at early vegetative stages and post-recovery.Drought triggered both general and organ-specific changes in endogenous phytohormones.A nonspecific response involved the accumulation of stress hormones abscisic acid(ABA)and salicylic acid(SA),alongside the suppression of growth hormones indole-3-acetic acid(IAA)and gibberellins.However,hormone dynamics and localization varied across plant organs.ABA and SA levels significantly increased in shoots of drought-stressed and recovered plants,corresponding with inhibited growth.Prolonged drought further enhanced ABA accumulation in both shoots and roots of recovered plants,while SA levels declined in roots but remained elevated in shoots.Drought also caused a substantial reduction in IAA,particularly in shoots,while gibberellins(GA_(3)+GA_(4))significantly decreased in roots.GA_(3)was predominant in most samples,except in the shoots of 2-day-old control plants.Post-recovery,IAA levels increased but remained below control values,while GA_(4)accumulation in roots led to a rise in total gibberellin levels.In contrast,shoot GA_(3)+GA_(4)levels declined,primarily due to GA_(3)reduction.The dominant free amino acids:aspartic acid,glutamic acid,glycine,alanine,and leucinedecreased significantly,underscoring their key role in stress adaptation.Increased flavonoid accumulation,especially in roots,suggests their involvement in antioxidant defense against oxidative stress.A significant increase in ABA and SA levels,along with a marked reduction in IAA and GA content in stressed rye plants occurred alongside a reduction in free amino acid content,accumulation of phenolic compounds,and an increase in flavonoid levels.These findings indicate distinct adaptation strategies in rye shoots and roots undermoderate soil drought.They provide a foundation for further research on drought resistance mechanisms in cereals and the development of strategies to enhance their adaptive potential.
基金funded by National Natural Science Foundation of China(22278023,22208010)S&T Program of Hebei(24464301D)SINOPEC Group(24-ZS-0447).
文摘Phenol is extensively utilized in various industries involving paints,rubber,textiles,explosives,plastics,etc.Compared to the conventional distillation or extraction technologies,pervaporation(PV)membrane process can be operated at a low temperature and has a low energy consumption as well as a high separation efficiency for phenol recovery.Thus,to meet the high demand for phenol recovery,the application of PV has been encouraged,and reached a new level.The PV process is governed by the properties of the membrane materials that significantly influence the energy costs associated with the separation unit,and the membrane types include polymer membranes,inorganic membranes,and mixed matrix membranes.Although recent literatures show that PV membranes have been continuously updated,no review has reported the latest development about it.In this work,the material types,separation properties and preparation methods of hydrophobic PV membranes for phenol recovery are summarized.Furthermore,the key preparation methods and application challenges associated with membranes are summarized,along with an overview of the opportunities and challenges posed by hydrophobic PV membranes for phenol recovery.
基金financially supported by grants from the National Natural Science Foundation of China(Grant No.81503180)the Opening Project of Zhejiang Provincial Key Laboratory of Resources Protection and Innovation of Traditional Chinese Medicine(Grant No.2021E10013)+1 种基金the Opening Project of NMPA Key Laboratory for Quality Research and Evaluation of Traditional Chinese Medicine(Grant No.AHYJ-KFKT-202101)the Earmarked fund for Jiangsu Agricultural Industry Technology System(Grant No.JATS[2022]460)。
文摘Chrysanthemum morifolium Ramat.is an important industrial crop with a high medicinal value,whose capitulum consists of ray and disc florets containing numerous bioactive components,such as flavonoids and phenolic acids.However,the distribution and accumulations of the bioactive metabolites in florets of Chrysanthemum morifolium were unclear.Herein,the ray and disc florets of Chrysanthemum morifolium were separated for comparing the bioactive metabolites.The contents of phenolic compounds and antioxidant activities were significantly different between the two florets.The metabolomic analysis identified 203 and 241 differential metabolites between ray and disc florets at two flowering stages.The derivatives of quercetin,isorhamnetin,tricin,and caffeoylquinic acid were enriched in the disc florets,while apigenin,kaempferol,acacetin,and their glycosides mainly accumulated in the ray florets.Besides,the results of transcriptome and qRT-PCR suggested that the F3H,F3'H,and FLS genes highly expressed in disc florets,while the FNS gene was well expressed in ray florets,which explained the different distribution of phenolic compounds between ray and disc florets.Furthermore,the expression of CmCYC2 genes was found to be significantly related to the distribution of flavones by correlation analysis.It was proved by the luciferase reporter assay that CmCYC2a and CmCYC2d factors could bind and activate the CmFNS promoter to regulate the flavones biosynthesis in ray florets.These results revealed the significant difference of metabolite contents and gene expression profile between ray and disc floret in Chrysanthemum morifolium and demonstrated that the quality of Chrysanthemum morifolium‘Hangju'was closely relevant to its flower morphology.
基金supported by Major Project of Science and Technology Department of Yunnan Province(202002AA100005,202102AE090027-2)National Natural Science Foundation of China(82260703)+1 种基金Cassava Industrial Technology System of China(CARS11-YNTY)Yunnan Province Ten Thousand Plan Industrial Technology Talents Project(YNWR-CYJS-2020-010)。
文摘Moringa oleifera Lam.is a Moringa genus in the Moringaceae family that is high in nutrients and has a wide range of applications.Phenolic compounds are widely found in plants and have various health benefits for the human body.With its high content and wide variety of phenolic compounds,M.oleifera Lam.has been widely studied for its health benefits.The phenolic compounds in M.oleifera Lam.(MOPCs)can be a potential source of functional food ingredients in pharmaceutical and industrial applications.Numerous studies have shown that MOPCs have antioxidant,anti-obesity,anti-diabetic,and antibacterial effects.Although the research on MOPCs has been gradually increasing,the extraction,isolation,identification,biological activities,and comprehensive application of MOPCs need a more systematic summary and generalization.Therefore,this paper reviews the isolation and extraction methods,structure identification,biological activities,and comprehensive applications to provide a further reference for the research and application of MOPCs.
基金supported by the National Key Research and Development Program of China(No.2023YFC3706602)the National Natural Science Foundation of China(Nos.22225605 and 22193051)the Strategic Priority Research Program of the Chinese Academy of Sciences(No.XDB0750200).
文摘Synthetic phenolic antioxidants(SPAs)are widely used in diverse industries due to their exceptional antioxidant characteristics.However,human exposure to SPAs may cause health problems.In this study,226 dust samples were collected from 10 provinces in China,and six SPAs(three parent SPAs and their three transformation products)were analyzed.The concentrations of6SPAs(the sum of six target compounds)ranged from 15.4 to 3210 ng/g(geometric mean(GM):169 ng/g).The highest concentration of6SPAswas found in Sichuan Province(GM:349 ng/g),which was approximately 4 times higher than that in Hubei Province(81.6 ng/g)(p<0.05).The concentrations of butylated hydroxytoluene(BHT),2,2'-methylene bis(4-methyl-6–tert-butylphenol)(AO2246),2,6-di–tert–butyl–1,4-benzoquinone(BHT-Q),2,6-di–tert–butyl–4-(hydroxymethyl)phenol(BHT-OH),and ∑_(p)-SPAs were substantially higher in dust from urban areas than rural areas(p<0.05).AO2246 concentration in dust from homes(GM:0.400 ng/g)was about 4 times higher than that in workplaces(0.116 ng/g)(p<0.01).Significantly higherp-SPAs concentrations were found in dust from homes(GM:17.5 ng/g)than workplaces(11.4 ng/g)(p<0.01).The estimated daily intakes(EDIs)of ∑_(6)SPAs exposed through dust ingestion were 0.582,0.342,0.197,0.076,and 0.080 ng/kg bw/day in different age groups,and exposed through dermal contact was 0.358,0.252,0.174,0.167,and 0.177 ng/kg bw/day.EDIs showed that the exposure risks of SPAs decreased with age.This is the first work to determine SPAs in dust from10 provinces in China and investigate the spatial distribution of SPAs in those regions.
基金Funded by the National Natural Science Foundation of China(Nos.52171045,52162013,and 51932006)。
文摘The surface of MoSi2-SiB6/phenolic resin matrix composites was modified by mica,and the thermal oxidation behavior of the composites and the mechanical properties of the pyrolysis products were studied.The results showed that the mica improved the thermal properties of the composites,the thermal expansion coefficient decreased,and the liquid phase formation caused the composites to shrink and increase the density.The flexural strength of mica surface modified composites not only increased to 78.64MPa after thermal treatment at 800-1200℃,but reached 83.02 MPa after high temperature treatment at1400℃.The improvement of the mechanical properties of the residual product benefits from the formation of high temperature ceramic phases such as Mo_(2)C and MoB,and the improvement of the shear strength of the composites by the mica.The shear strength of MBm5-2 at room temperature reached 33.08 MPa,indicating that the improvement of the interlayer properties of the composites further improved its mechanical properties.
基金supported by the National Natural Science Foundation of China(Grant Nos.U2241240,12172045,and 12221002).
文摘In thermal protection structures,controlling and optimizing the surface roughness of carbon/phenolic(C/Ph)composites can effectively improve thermal protection performance and ensure the safe operation of carriers in high-temperature environments.This paper introduces a machine learning(ML)framework to forecast the surface roughness of carbon-phenolic composites under various thermal conditions by employing an ML algorithm derived from historical experimental datasets.Firstly,ablation experiments and collection of surface roughness height data of C/Ph composites under different thermal environments were conducted in an electric arc wind tunnel.Then,an ML model based on Ridge regression is developed for surface roughness prediction.The model involves incorporating feature engineering to choose the most concise and pertinent features,as well as developing an ML model.The ML model considers thermal environment parameters and feature screened by feature engineering as inputs,and predicts the surface height as the output.The results demonstrate that the suggested ML framework effectively anticipates the surface shape and associated surface roughness parameters in various heat flow conditions.Compared with the conventional 3D confocal microscope scanning,the method can obtain the surface topography information of the same area in a much shorter time,thus significantly saving time and cost.
基金supported by the National Natural Science Foundation of China(No.51872232)the Key Scientific and Technological Innovation Research Team of Shaanxi Province(No.2022TD-31)the Key R&D Program of Shaanxi Province(No.2021ZDLGY14-04).
文摘Carbon fiber/phenolic resin composites have great potential application in the field of electronic information,where excellent structural-functional integration is required.In this work,the establishment of interfacial structures consisting of carbon nanotubes with different morphologies at the fiber/matrix interface is conducive to the further modulation of the mechanical,tribological,electromagnetic interference(EMI)shielding and thermal conductivity properties of carbon fiber/phenolic resin composites.Specially,array carbon nanotubes can deep into the resin matrix,effectively hindering crack extension,and constructing an electrically and thermally conductive network.Compared with the carbon fiber/phenolic composites,the tensile strength and modulus of elasticity(163.86±9.60 MPa,5.06±0.25 GPa)of the array carbon nanotubes reinforced carbon fiber/phenolic composites were enhanced by 57.09%and 22.22%.The average friction coefficient and wear rate(0.20±0.02,1.11×10^(-13)±0.13×10^(-13)m^(3)N^(−1)m^(−1))were reduced by 39.39%and 74.31%.EMI shielding effectiveness up to 40 dB in the X-band at 0.4 mm sample thickness,diffusion coefficient(0.39±0.003 mm^(2)/s)and thermal conductivity(0.54±0.004 W/(m K))were enhanced by up to 14.37%and 50.42%.This study reveals the beneficial effects of morphological changes of carbon nanotubes on the design of interfacial structure,proposes the reinforcement mechanism of array carbon nanotubes,and opens up the prospect of carbon fiber/phenolic composites for electronic applications.
基金Funded by by the Wuhan Science and Technology Project(No.2024010702030141)。
文摘A Ti_(3)SiC_(2)-modified high-silica oxygen/phenolic aerogel composite with excellent oxidation resistance and high-temperature performance was prepared.The experimental results show that the obtained composite has significantly improved oxidation resistance.When the addition amount of Ti_(3)SiC_(2)is 75%,the carbonization volume shrinkage rate of the composite after aerobic static combustion is only 5.95%.At the same time,the LAR and MAR after 30 seconds of oxyacetylene ablation under a heat flux density of 1.5 MW/m2 are 0.0307 mm/s and 0.0149 g/s,respectively.The compressive strength after aerobic static combustion at 1000℃is up to 20.43%of that before aerobic static combustion,which is 1.99 times that of the unfilled material,significantly improving the high-temperature mechanical properties of the composite.
基金supported by the National Natural Science Foundation of China(NSFC,Nos.21901018,21971024,22271021)the Natural Science Foundation and Education Department of Liaoning province(Nos.2022-MS-373,2021-MS-312,LJ2020008).
文摘The widespread application of phenolic substances in the field of food,medicine and industry,is harmful to the environment and human health.Therefore,it is very important to develop a con-venient and effective method to detect and degrade phenolic compounds.Herein,we report a new keggin-type polyoxometallate-based metal-organic complex self-assembled under solvothermal condition,{[Cu(dap)(3-PA)]4(SiW_(12)O_(40))(H_(2)O)_(2)}·2H_(2)O(1,dap=1,2-diaminopropane,3-HPA=3-pyridineacrylic acid).1 shows an interesting 1D ladder-like structure.As a bifunctional catalyst,1 can be employed as a colori-metric sensor toward phenol with the relatively low detection limit(LOD)of 0.36μmol/L(S/N=3)in the wide range(0.001-0.1 mmol/L).The title colorimetric sensor is applied to determine phenol in various water environment with good recoveries ranging from 95%-105%.In addition,1 also exhibits excellent photocatalytic degradation toward phenol under visible light with the highest removal efficiency at 96%for 100 min and wide pH universality.The selectivity,stability and reliability of the detection of 1 towards phenol,as well as the detection for 4-chlorophenol,o-cresol,4-nitrophenol and phloroglucinol were stud-ied.Furthermore,the photocatalytic reaction kinetics and the mechanisms of photodegradation of phenol were also investigated in detail.
基金Supported by Agricultural Science and Technology Innovation Fund Project of Hunan Province(2022CX87)Huaihua Municipal Institute of Science and Technology Cooperation Project(2022N1203)Science and Technology Talent Lifting Project of Hunan Province—Training Plan for Young and Middle-aged Scholars(2023TJ-Z01)。
文摘Polyphenols were obtained from the natural dried Lonicerae flos by ultrasound-assisted extraction with ethanol as the solvent.Single factor experiment and response surface methodology were employed to optimize the extraction conditions.Ultra-performance liquid chromatrography(UPLC)-tandem mass spectrometry(MS/MS)was employed to identify polyphenols based on the plant widely targeted metabolomics database in a qualitative and quantitative manner.The results showed that the optimal extraction conditions for total phenols from Lonicerae flos were ultrasound-assisted extraction with a solid-to-liquid ratio of 10∶1 g/mL and 57%ethanol at 70 W and 60°C for 11 min.The yield of total phenols extracted under the optimal conditions reached 71.08 mg/g.The phenols in Lonicerae flos were mainly chlorogenic acid isomers,and the flavonoids were mainly nobiletin,galuteolin,and homoarbutin.
基金support of Youth Project of Liaoning Provincial Education Department(JYTQN2023334)Anhui Provincial Department of Education Key Research Project on Natural Science in Higher Education Institutions(KJ2021A1072)Science and Technology Plan Project of Chuzhou Science and Technology Bureau(2021ZD023).
文摘Quinoa is a good source of phenolics,which both exist as free and bound forms.In order to mark clear the characteristic free and bound phenolics in different quinoa samples,in this study,characteristic free and bound phenolics in three colored quinoas including WQ(white quinoa),RQ(red quinoa)and BQ(black quinoa)were investigated.Result showed a total of 14 phenolics both acted as free and bound form were analyzed in three colored quinoas(WQ,RQ and BQ).Gallic acid,vanillic acid,epicatechin,p-coumaric acid and quercetin existed both as free and bound forms were common phenolics in quinoas.The highest total free phenolics(238.10 mg/kg)and bound phenolics(3377.75 mg/kg)were presented in WQ and RQ,respectively.It indicated WQ and RQ were respectively good source of free and bound phenolics.Moreover,characteristic free and bound phenolics in three colored quinoas could be well analyzed by principal component analysis(PCA),indicating it was an effective and reliable method in distinguishing three colored quinoas based on their characteristic free and bound phenolics,respectively.
基金supported by the Beijing Natural Science Foundation(No.7222261)CAMS Innovation Fund for Medical Sciences(Nos.2022-I2M-01-015 and 2022-I2M-JB-010)+1 种基金Key R&D Program of Shan Dong Province(No.2019JZZY020909)Chinese Pharmacopoeia Commission Drug Standard Promoting Fund(No.2022Y01)。
文摘The virtual cocrystal screening approach based on molecular electrostatic potential surface(MEPS)maps is a fast and feasible computational method to estimate the probability of cocrystal formation by calculating the difference in the interaction site pairing energies of monomers and that of their assemblies prior to experimental screening.In this paper,we report 12 cocrystal forms of temozolomide with mono-,di-,and trihydroxy benzoic acids,namely,3-hydroxy-,2,4-dihydroxy-,2,5-dihydroxy-,2,6-dihydroxy-,3,4-dihydroxy-,and 3,4,5-trihydroxy-benzoic acids,as well as benzoic acid,as pharmaceutical coformers for the first time.10 single crystals out of the 12 cocrystal forms were obtained and unequivocally determined by single-crystal X-ray diffraction,which clarified spatial arrangements,molecular conformations,and supramolecular synthons.MEPS further gains some insights into the sites of hydrogen bonding interactions for exploring combination patterns in these assemblies.Modulated stability of TMZ was successfully achieved by cocrystallization with these acids.
基金the support from National Key Research and Development Program of China(2021YFC2104400)the Tianjin Science and Technology Plan Project(21JCQNJC00340)the Haihe Laboratory of Sustainable Chemical Transformations for financial support。
文摘Lignin is the most abundant naturally phenolic biomass,and the synthesis of high-performance renewable fuel from lignin has attracted significant attention.We propose the efficient synthesis of high-density fuels using simulated lignin cracked oil in tandem with hydroalkylation and deoxygenation reactions.First,we investigated the reaction pathway for the hydroalkylation of phenol,which competes with the hydrodeoxygenation form cyclohexane.And then,we investigated the effects of metal catalyst types,the loading amount of metallic,acid dosage,and reactant ratio on the reaction results.The phenol hydroalkylation and hydrodeoxygenation were balanced when 180℃ and 5 MPa H_(2)with the alkanes yield of 95%.By extending the substrate to other lignin-derived phenolics and simulated lignin cracked oil,we obtained the polycyclic alkane fuel with high density of 0.918 g·ml^(-1)and calorific value of41.2 MJ·L^(-1).Besides,the fuel has good low-temperature properties(viscosity of 9.3 mm^(2)·s^(-1)at 20℃ and freezing point below-55℃),which is expected to be used as jet fuel.This work provides a promising way for the easy and green production of high-density fuel directly from real lignin oil.
文摘Chlorine content and position of chlorinated phenols have many significant effects on the reactivity of oxido-reduction. The effects of chlorine content and position of chlorinated phenols on their oxidation kinetics by potassium permanganate were evaluated through different kinetics studies. Since chlorine was an electron withdrawing atom, the substitution of chlorine on the aromatic ring decreased the oxidation rate constant by σ-electron withdrawing conductive effect. The substitution of chlorine at ortho or para position on the aromatic ring increased the oxidation rate constant by π-electron donating conjugative effect, and the conjugative effect could counteract the negative impact of the conductive effect to some extent. On the other hand, the substitution of chlorine at ortho position on the aromatic ring decreased the oxidation rate constant by steric hindrance effect. The oxidation rate constants of phenol and chlorinated phenols studied decreased as follow order: 4-chlorophenol>2,4-dichlorophenol>phenol>2,6-dichlorophenol.
基金The Fundamental Research Program for Young Scientists of Shanxi Province(Project No.202103021223294)The Fundamental Research Program of Shanxi Province(Project No.202203021211203)+1 种基金The Start-up Fund for Doctorate Scientific Research Project of Taiyuan University of Science and Technology(Project No.20232124)The Innovation and Entrepreneurship Training Program for Undergraduate,Taiyuan University of Science and Technology(Project No.DCX2024162).
文摘The utilization of perovskite oxide materials as catalysts for the photodegradation of organic pollutants in water is a promising and rapidly advancing field.In this study,a series of La_(1−x)Ba_(x)CoO_(3)(x=0.2,0.3,0.4,0.5,0.6)catalysts with varying Ba doping ratios were synthesized using the citric acid complexation-hydrothermal synthesis combined method for the degradation of phenol under visible light irradiation.Among the synthesized catalysts,La_(0.5)Ba_(0.5)CoO_(3) exhibited the highest photocatalytic activity.In addition,the photocatalytic mechanism for La_(0.5)Ba_(0.5)CoO_(3) perovskite degradation of phenol was also discussed.The synthesized catalysts were characterized using XRD,SEM,FT-IR,XPS,MPMS and other characterization techniques.The results revealed that the diffraction peak intensity of La_(1−x)Ba_(x)CoO_(3) increased with higher Ba doping ratios,and the La_(0.4)Ba_(0.6)CoO_(3) exhibited the strongest diffraction peaks.The catalyst particle sizes ranged from 10 to 50 nm,and the specific surface area decreased with increasing Ba content.Additionally,the paramagnetic properties of La_(0.5)Ba_(0.5)CoO_(3) were similar to that of La_(0.4)Ba_(0.6)CoO_(3).The experimental results suggested that the incorporation of Ba could significantly improve the catalytic performance of La_(1−x)Ba_(x)CoO_(3) perovskites,promote electron transfer and favor to the generation of hydroxyl radicals(•OH),leading to the efficiently degradation of phenol.
文摘Recent studies have highlighted the potential of plant extracts as therapeutic agents for managing oxidative stress and related disorders.This study aims to elucidate the phenolic composition and antioxidant properties of Gymnema sylvestre extracts.Ethanolic reflux extraction followed by column chromatography was employed to isolate phenolic compounds.The total phenolic and flavonoid contents were quantified using the Folin–Ciocalteu and aluminum chloride colorimetric methods,respectively.Antioxidant activities were assessed by DPPH,ABTS scavenging assays and the ferric reducing antioxidant power(FRAP)assay.High-Performance Liquid Chromatography(HPLC)with a C18 column and Thermo TSQ Quantum Access Max(LC-MS)were used to determine the levels of gymnemic acid and identify other potential phenolic compounds.The analysis revealed significant antioxidant activities in the fractions.Fraction A showed the highest DPPH and ABTS scavenging activities,and Fraction C demonstrated the highest ferric reducing power.LC-MS analysis identified several phenolic compounds,indicating that these are major contributors to the antioxidant efficacy of the extract.This study provides a detailed phenolic profile and confirms the strong antioxidant potential of Gymnema sylvestre leaf extract,supporting its therapeutic use and further investigation.
