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Blue LEDs-induced synthesis of aryl-alkyl thioethers from diary disulfides and alkylboronic pinacol esters 蓝光发光二极管诱导下由二硫化物和烷基硼醇酯合成芳基烷基硫醚
IF 1.6 4区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2025-09-02 Epub Date: 2025-07-23 DOI: 10.1080/10426507.2025.2539400
Jian-Qiu Zhang (Conceptualization Data curation Investigation Methodology Supervision Writing – original draft) , Dai Xiaoqiang (Data curation) , Yongbo Zhou (Formal analysis Supervision) , Li-Biao Han (Supervision)
A facial protocol was developed for the synthesis of aryl-alkyl thioethers through LEDs-induced cross coupling of diaryl disulfide and alkylboronic pinacol esters assisted with N-nitrosomorpholine. This transformation proceeded efficiently under mild conditions and delivered the corresponding thioethers in good to excellent yields.
采用led诱导二芳基二硫醚和烷基硼松酚酯在n -亚硝基somorpholine辅助下交叉偶联的方法合成芳基烷基硫醚。这种转化在温和的条件下进行得很有效,并产生了相应的硫醚,收率很高。
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引用次数: 0
Theoretical and experimental approaches to thiosemicarbazone: spectroscopy, molecular docking and ADMET studies 硫代氨基脲的理论和实验方法:光谱学、分子对接和ADMET研究
IF 1.6 4区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2025-09-02 Epub Date: 2025-07-30 DOI: 10.1080/10426507.2025.2541791
Narender Singh (Conceptualization Methodology Project administration Resources Visualization Writing – original draft Writing – review & editing) , Zahraddin Ali Jogana (Data curation Investigation Methodology Project administration Resources Validation Writing – original draft Writing – review & editing) , Sonia Khanna (Conceptualization Data curation Formal analysis Investigation Methodology Project administration Supervision Validation Visualization Writing – original draft Writing – review & editing)
In the present study, 2, 4-Dihydroxyacetophenone thiosemicarbazone (2,4-DAPTZ) and 2, 6-Dihydroxyacetopheone thiosemicarbazone (2,6-DAPTZ) were synthesized by the refluxing method. The structure of the synthesized compounds were characterized by using spectroscopic techniques such as: 1H NMR,13C NMR, IR and UV-Vis. In Silico Molecular docking, ADMET profiling, drug-likeness evaluation, and PASS prediction analyses were carried out to assess the drug potential of the synthesized compounds. Molecular docking was conducted against the BRAF and TGF-β1 proteins (PDB IDs: 6V34 and 3RJR), revealing moderate binding affinities through conventional hydrogen bonding interactions, with docking scores ranging from −5.9 to −6.6 kcal/mol. Furthermore, molecular docking also done with the known inhibitor of proteins i.e Vemurafenib and Galunisertib taking them as control for the comparative study. Both compounds exhibited favorable ADMET characteristics and satisfied key drug-likeness criteria. Furthermore, PASS prediction indicated promising Pa values for anti-tuberculosis, anti-viral, and anticarcinogenic activities. These findings suggest that 2,4-DAPTZ and 2,6-DAPTZ possess significant potential as lead candidates for further In vitro biological evaluation and therapeutic development.
本研究采用回流法制备了2,4-二羟基苯乙酮硫代氨基脲酮(2,4- daptz)和2,6-二羟基苯乙酮硫代氨基脲酮(2,6- daptz)。采用1H NMR、13C NMR、IR和UV-Vis等光谱技术对合成的化合物进行了结构表征。在硅分子对接、ADMET分析、药物相似性评价和PASS预测分析中,对合成的化合物进行药物潜力评价。对BRAF和TGF-β1蛋白(PDB id: 6V34和3RJR)进行分子对接,通过常规氢键相互作用显示出中等的结合亲和性,对接得分在−5.9 ~−6.6 kcal/mol之间。此外,还与已知的蛋白质抑制剂Vemurafenib和Galunisertib进行了分子对接,并将其作为对照进行比较研究。这两种化合物都表现出良好的ADMET特性,并满足关键的药物相似标准。此外,PASS预测显示Pa值具有抗结核、抗病毒和抗癌活性。这些发现表明2,4- daptz和2,6- daptz作为进一步的体外生物学评价和治疗开发的主要候选物具有重要的潜力。
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引用次数: 0
Wittig reaction purification for products with very low polarity 极低极性产物的Wittig反应纯化
IF 1.6 4区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2025-09-02 Epub Date: 2025-08-08 DOI: 10.1080/10426507.2025.2546578
Yi Cui (Methodology)
The Wittig reaction is widely used for alkene synthesis. However, the excessive use of Wittig reagents frequently results in phosphorus-containing impurities. The purification of products with very low polarity - characterized by retention factors greater than 0.5 in petroleum ether when monitored via thin-layer chromatography - poses a challenge for conventional column chromatography. Notably, phosphorus-containing compounds exhibit sensitivity to metals, potentially interfering with subsequent reactions. In this study, we demonstrate that low-polarity phosphorus-containing impurities generated during the Wittig reaction can be transformed into high-polarity derivatives using readily available laboratory reagents. This modification facilitates their removal via rapid column chromatography, yielding alkenes free from phosphorus contaminants.
Wittig反应广泛用于烯烃的合成。但是,过度使用威氏试剂往往会产生含磷杂质。极低极性产品的纯化——其特征是在薄层色谱中石油醚的保留系数大于0.5——对传统柱层析提出了挑战。值得注意的是,含磷化合物对金属表现出敏感性,可能会干扰随后的反应。在这项研究中,我们证明了在Wittig反应中产生的低极性含磷杂质可以用现成的实验室试剂转化为高极性衍生物。这种改性有利于通过快速柱色谱法去除它们,产生不含磷污染物的烯烃。
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引用次数: 0
Synthesis, antioxidant activity, antimicrobial activity, and fluorescent property of furan-/pyridine aminophosphonate derivatives 呋喃/吡啶氨基膦酸衍生物的合成、抗氧化活性、抗菌活性和荧光特性
IF 1.6 4区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2025-09-02 Epub Date: 2025-07-28 DOI: 10.1080/10426507.2025.2538483
Yanan Han (Data curation) , Yu Li (Methodology) , Danfeng He (Formal analysis Funding acquisition Supervision) , Si Ke (Data curation) , Duanyi Zhang (Formal analysis) , Ziwei Gong (Project administration) , Wenhui Ma (Investigation Resources Writing – review & editing) , Ming Zhao (Conceptualization Supervision) , Wanxia Tang (Funding acquisition Resources Software Supervision Writing – original draft Writing – review & editing)
Eight new furan-/pyridine aminophosphonate derivatives A1A4 and B1B4 were synthesized by a one-pot Kabachnik–Fields reaction of diethyl phosphite with furfural (pyridine-2-aldehyde) and four different amines with phenyl group. The structures of the synthesized compounds were elucidated by the spectral analysis using 1H,13C and 31P NMR as well as IR and FTMS. The results of antioxidant experiments showed that compounds A3 and B3 display intermediate antioxidant activity at the concentration range of 1–100 µM and IC50 value of 2.02 µM and 2.87 µM, respectively. According to the results of antimicrobial experiments, these eight compounds showed differently strong anti-fungal and antibacterial activity in the concentration range of 125–1000 μg/mL. Fluorescent experiments revealed that the emission wavelength range of A1A4 and B1B4 is between 650 nm and 750 nm at the concentration of 1 × 10−5 mol/L. A single crystal of B2 was selected for X-ray crystallography. The compound crystallizes in a monoclinic system with space group C2/c.
以亚磷酸二乙酯与糠醛(吡啶-2-醛)和4种不同的胺与苯基一锅Kabachnik-Fields反应合成了8个新的呋喃/吡啶氨基膦酸衍生物A1-A4和B1-B4。通过1H、13C、31P NMR、IR和FTMS对合成化合物的结构进行了表征。抗氧化实验结果表明,化合物A3和B3在1 ~ 100µM浓度范围内具有中等抗氧化活性,IC50值分别为2.02µM和2.87µM。抑菌实验结果表明,8种化合物在125 ~ 1000 μg/mL浓度范围内表现出不同程度的抗真菌和抗菌活性。荧光实验表明,在浓度为1 × 10−5 mol/L时,A1-A4和B1-B4的发射波长范围在650 ~ 750 nm之间。选择B2单晶进行x射线晶体学研究。该化合物在空间群为C2/c的单斜晶系中结晶。
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引用次数: 0
Dendrimeric bis(piperazine) coupled schiff base ligand synthesized with mannich reaction and its Pd(II), oxo-V(IV) complexes supported on nano-magnetite: Most effective, green and recoverable catalyses under microwave power 曼尼希反应合成树状双(哌嗪)偶联席夫碱配体及其载于纳米磁铁矿上的Pd(II)、氧- v (IV)配合物:微波功率下最有效、绿色、可回收的催化剂
IF 1.6 4区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2025-09-02 Epub Date: 2025-07-22 DOI: 10.1080/10426507.2025.2533371
Serhan Uruş (Conceptualization Data curation Formal analysis Funding acquisition Investigation Methodology Project administration Resources Software Supervision Visualization Writing – original draft Writing – review & editing) , Ferudun Koçer (Data curation Formal analysis Methodology Software Visualization Writing – original draft Writing – review & editing) , Beyhan Tahta (Data curation Methodology Software Visualization Writing – original draft Writing – review & editing) , Mahmut Çaylar (Formal analysis Methodology Software Visualization Writing – original draft Writing – review & editing)
Vitamin K3 is a synthetic member of Vitamin K group used as a nutritional supplement. The best recyclable and very efficient heterogenous catalysts containing piperazine substituents used in the green synthesis of vitamin K3 without any hazardous waste in short reaction times under microwave power. Firstly, N-methyl-substituted piperazine was coupled with 2,4-dihydroxybenzaldehyde as the route of Mannich reaction and the synthesized compound was reacted with aminosilane modified nano-structured Fe3O4. After, Pd(II) and oxo-V(IV) complexes of the obtained ligant were synthesized and all the synthesized compounds were characterized by using FT-IR, LC-MS/MS, SEM, EDX, TEM, TG/DTG/DTA, XRD and NMR techniques. The microwave assisted catalytic activities of the synthesized nano-Fe3O4 supported Pd(II) and oxo-V(IV) type complexes were investigated in the oxidative catalytic synthesis of vitamin K3 from 2-methyl-napthtalene (2MN) using green oxidant (H2O2). Heterogenous nano-Fe3O4-supported-Pd(II) complex was showed one of the best efficient catalytic activites with highly selectivities compared to the literature. The converison of Fe3O4@SiO2-L-Pd(II) complex was calculated as 91.29 ± 0.37% with a selectivity of 72.39 ± 0.46%. Fe3O4@SiO2-LOV(IV) complex was conversed the substrate with 88.56 ± 0.48% and 61.25 ± 0.24 selectivity. Pd(II) complex can be used in five cycles as an efficient catalyt in the recycles process with a selectivity of 45.57 ± 0.41% in the 91.33 ± 0.29% conversion.
维生素K3是维生素K族的合成成员,用作营养补充剂。采用含哌嗪取代基的多相催化剂,在微波功率下短时间无有害废弃物的绿色合成维生素K3。首先,以n -甲基取代哌嗪与2,4-二羟基苯甲醛偶联为曼尼希反应途径,与氨基硅烷修饰的纳米结构Fe3O4反应合成化合物。然后合成Pd(II)和oxo-V(IV)配合物,并利用FT-IR、LC-MS/MS、SEM、EDX、TEM、TG/DTG/DTA、XRD和NMR等技术对合成的化合物进行表征。研究了合成的纳米fe3o4负载Pd(II)和o- v (IV)型配合物在绿色氧化剂(H2O2)氧化催化2-甲基萘(2MN)合成维生素K3中的微波催化活性。与文献相比,多相纳米fe3o4负载的pd (II)配合物具有较高的选择性,是催化活性最好的材料之一。Fe3O4@SiO2-L-Pd(II)配合物的转化率为91.29±0.37%,选择性为72.39±0.46%。Fe3O4@SiO2-LOV(IV)配合物对底物的转化率分别为88.56±0.48%和61.25±0.24。Pd(II)配合物可作为高效催化剂循环使用5次,转化率为91.33±0.29%,选择性为45.57±0.41%。
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引用次数: 0
Design, synthesis, and antifungal activity of novel sulfone derivatives incorporating 1,3,4-oxadiazole and pyrimidine moieties 含有1,3,4-恶二唑和嘧啶的新型砜衍生物的设计、合成和抗真菌活性
IF 1.4 4区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2025-07-03 Epub Date: 2025-06-05 DOI: 10.1080/10426507.2025.2517262
Tao Wang (Funding acquisition Methodology Project administration Writing – original draft Writing – review & editing) , Lingling Xiao (Data curation Methodology) , Yanling Ren (Data curation Methodology) , Shoumei Wang (Data curation Methodology) , Haiyan Wang (Data curation Methodology) , Lu Yu (Conceptualization Data curation Methodology Software Writing – review & editing) , Pei Li (Methodology Project administration Writing – original draft Writing – review & editing)
In this study, a series of novel sulfone derivatives incorporating 1,3,4-oxadiazole and pyrimidine moieties were synthesized and confirmed their structures by 1H NMR,13C NMR, and HRMS. Their in vitro antifungal activities of the target compounds against Dothiorella gregaria (D. gregaria), Diaporthe phaseolorum (D. phaseolorum), Daldinia childiae (D. childiae), Colletotrichum godetiae (C. godetiae), Fusarium tricinctum (F. tricinctum), Neofusicoccum parvum (N. parvum), Botryosphaeria dothidea (B. dothidea), and Epicoccum sorghinum (E. sorghinum) at 100 and 50 µg/mL were determined by the mycelium growth rate method. The bioassay results demonstrate that the target compounds exhibit comparatively lower antifungal activities against the eight plant pathogenic fungi in comparison to imazalil sulfate. To the best of our knowledge, this study presents the first report on the synthesis and antifungal activity evaluation of sulfone derivatives incorporating 1,3,4-oxadiazole and pyrimidine moieties.
本研究合成了一系列含有1,3,4-恶二唑和嘧啶基团的新型砜衍生物,并通过1H NMR、13C NMR和HRMS对其结构进行了确证。采用菌丝体生长速率法测定目标化合物在100和50 μ g/mL条件下对灰虱(dothiorelia gregaria)、phaseolorum (D. phaseolorum)、Daldinia childiae (D. childiae)、godetiae (C. godetiae)、tricinctum (F. tricinctum)、Neofusicoccum parvum (N. parvum)、dothidea (B. dothidea)和高粱表绦虫(E. sorghinum)的体外抑菌活性。生物实验结果表明,目标化合物对8种植物病原真菌的抑菌活性较硫酸伊马唑低。据我们所知,本研究首次报道了含有1,3,4-恶二唑和嘧啶的砜衍生物的合成和抗真菌活性评价。
{"title":"Design, synthesis, and antifungal activity of novel sulfone derivatives incorporating 1,3,4-oxadiazole and pyrimidine moieties","authors":"Tao Wang (Funding acquisition Methodology Project administration Writing – original draft Writing – review & editing) ,&nbsp;Lingling Xiao (Data curation Methodology) ,&nbsp;Yanling Ren (Data curation Methodology) ,&nbsp;Shoumei Wang (Data curation Methodology) ,&nbsp;Haiyan Wang (Data curation Methodology) ,&nbsp;Lu Yu (Conceptualization Data curation Methodology Software Writing – review & editing) ,&nbsp;Pei Li (Methodology Project administration Writing – original draft Writing – review & editing)","doi":"10.1080/10426507.2025.2517262","DOIUrl":"10.1080/10426507.2025.2517262","url":null,"abstract":"<div><div>In this study, a series of novel sulfone derivatives incorporating 1,3,4-oxadiazole and pyrimidine moieties were synthesized and confirmed their structures by <sup>1</sup>H NMR,<sup>13</sup>C NMR, and HRMS. Their <em>in vitro</em> antifungal activities of the target compounds against <em>Dothiorella gregaria</em> (<em>D. gregaria</em>), <em>Diaporthe phaseolorum</em> (<em>D. phaseolorum</em>), <em>Daldinia childiae</em> (<em>D. childiae</em>), <em>Colletotrichum godetiae</em> (<em>C. godetiae</em>), <em>Fusarium tricinctum</em> (<em>F. tricinctum</em>), <em>Neofusicoccum parvum</em> (<em>N. parvum</em>), <em>Botryosphaeria dothidea</em> (<em>B. dothidea</em>), and <em>Epicoccum sorghinum</em> (<em>E. sorghinum</em>) at 100 and 50 µg/mL were determined by the mycelium growth rate method. The bioassay results demonstrate that the target compounds exhibit comparatively lower antifungal activities against the eight plant pathogenic fungi in comparison to imazalil sulfate. To the best of our knowledge, this study presents the first report on the synthesis and antifungal activity evaluation of sulfone derivatives incorporating 1,3,4-oxadiazole and pyrimidine moieties.</div></div>","PeriodicalId":20056,"journal":{"name":"Phosphorus, Sulfur, and Silicon and the Related Elements","volume":"200 7","pages":"Pages 565-568"},"PeriodicalIF":1.4,"publicationDate":"2025-07-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144587409","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Pulse laser deposition prepared tin(IV) oxide thin films: effects of gamma radiation doses on their structural and optical characteristics 脉冲激光沉积制备氧化锡薄膜:γ辐射剂量对其结构和光学特性的影响
IF 1.4 4区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2025-07-03 Epub Date: 2025-06-14 DOI: 10.1080/10426507.2025.2519510
Noha H. Harb (Conceptualization) , Hiba Al-Hameed (Investigation) , Baydaa Taher Sih (Supervision) , Falah A-H. Mutlak (Writing – original draft Writing – review & editing)
This work studied the effects of gamma radiation on the structural and optical properties of SnO2 thin films in a dose-dependent manner. The microstructural change was confirmed by peak shifting, peak broadening, and changes in grain size with an increase in radiation dose, as observed from X-ray diffraction analysis. Changes in the intensity of photoluminescence spectra and optical properties are due to radiation-induced defect states. The obtained results indicate that gamma irradiation can be used to tailor the characteristics of SnO2 for various applications. In contrast to previous works, this study quantitatively connects radiation dose to structural and optical transformations, thereby addressing the fundamental mechanisms of defect formation.
本文研究了γ辐射对SnO2薄膜结构和光学性质的剂量依赖性影响。x射线衍射分析表明,随着辐照剂量的增加,材料的峰移、峰展宽和晶粒尺寸发生了变化。光致发光光谱强度和光学性质的变化是由于辐射引起的缺陷态。得到的结果表明,伽马辐射可以用于定制SnO2的各种应用特性。与以往的工作相比,本研究定量地将辐射剂量与结构和光转换联系起来,从而解决了缺陷形成的基本机制。
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引用次数: 0
Performance of silixol on crop productivity and soil health enhancement in black gram (Vigna mungo L.) for sustainable agriculture 硅油醇对可持续农业黑克兰作物生产力和土壤健康的促进作用
IF 1.4 4区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2025-07-03 Epub Date: 2025-06-23 DOI: 10.1080/10426507.2025.2523958
P. Murali Arthanari (Conceptualization Investigation) , M. Sakila (Formal analysis) , K. G. Anitha (Visualization) , R. Arockia Infant Paul (Methodology) , R. Sathya Priya (Writing – review & editing) , N. Jagathjothi (Writing – review & editing) ,  M. Yuvaraj (Writing – original draft) , P Panneerselvam (Writing – original draft) , R. Sharmila (Writing – review & editing)
The decline in black gram yield was primarily linked to rainfed crops, poor nutrient management, inadequate assimilate partitioning, flower dropping, poor pod setting, and physiological issues. Fertilizers with foliar spray at the reproductive stage in pulse could aid it by directly delivering the nutrients to the site of food synthesis, resulting in a faster food supply and improved crop performance. The trials were conducted to assess the efficacy of silixol on black gram growth and yield as well as soil health. Treatments including 50% RDF combined with vermicompost (VC), silixol granules soil application (SA), and silixol foliar spray (FS) are examined in the RCBD with three replications. Results revealed that 50% RDF + VC at 2.5 t/ha + silixol granules (SA) at 20 kg/ha + silixol (FS) at 1% on 40 DAS showed significant improvement in plant height (67.5 cm), DMP (1959 kg/ha), LAI (2.24), chlorophyll content (94.95 SPAD value) on 60 DAS, root nodules (667 Nos/plant) and grain yield (849 kg/ha) with 61% increase over RDF alone. Similarly, an increase in the soil microbial biomass carbon, dehydrogenase activity, and microbial population by 16.0%, 59.6% and 31.8%, respectively were by applying silixol granules with foliar spray in combination with integrated fertilization over control.
黑克产量的下降主要与雨养作物、营养管理不善、同化物分配不足、落花、结荚不良和生理问题有关。在繁殖阶段进行叶面喷施肥料,可以直接将养分输送到食物合成部位,从而加快食物供应,提高作物性能。本试验旨在评价硅氧醇对黑克生长、产量和土壤健康的影响。通过3个重复试验,研究了50% RDF与蚯蚓堆肥(VC)、硅氧醇颗粒土壤施用(SA)和硅氧醇叶面喷雾(FS)相结合的处理。结果表明,50% RDF + 2.5 t/ha的VC + 20 kg/ha的硅氧醇颗粒(SA) + 1%的硅氧醇(FS)在40 DAS上的株高(67.5 cm)、DMP (1959 kg/ha)、LAI(2.24)、叶绿素含量(94.95 SPAD值)、根瘤(667 Nos/株)和籽粒产量(849 kg/ha)显著提高,比单独RDF提高61%。叶面喷施硅油醇颗粒与综合施肥相结合,土壤微生物生物量碳、脱氢酶活性和微生物数量分别比对照增加16.0%、59.6%和31.8%。
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引用次数: 0
Comparative study on early and late-stage crystallization of urea phosphate from untreated Moroccan phosphoric acid 未经处理的摩洛哥磷酸制备磷酸脲早、后期结晶的比较研究
IF 1.4 4区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2025-07-03 Epub Date: 2025-06-07 DOI: 10.1080/10426507.2025.2517258
Ayoub Cherrat (Conceptualization Data curation Formal analysis Funding acquisition Investigation Methodology Project administration Resources Software Supervision Validation Visualization Writing – original draft Writing – review & editing) , Yassine Ennaciri (Formal analysis) , Aziz Azifa (Formal analysis) , El Mostafa Erradi (Formal analysis) , Boujemaa Drif (Formal analysis) , Mohamed Oubaouz (Formal analysis) , Niraka Blaise (Formal analysis) , Hicham El Ossmani (Formal analysis) , Najoua Labjar (Methodology Resources) , H. El Alaoui-Belghiti (Software) , Souad El Hajjaji (Validation Visualization) , Mohammed Bettach (Methodology Validation Visualization)
Morocco is one of the world’s leading phosphate producers, converting its phosphate reserves into phosphoric acid, which is further used to produce urea phosphate. Urea phosphate is a valuable source of nitrogen and phosphorus for plant growth. However, phosphoric acid purification in Morocco is crucial to ensure high-quality urea phosphate production. In this study, we synthesized urea phosphate via an exothermic reaction of urea and phosphoric acid under optimized conditions for 90 min. Crystals began to form after 60 min, and the final sample was taken after 90 min. Elemental and morphological analyses confirmed the high purity of the synthesized urea phosphate crystals. XRD and FT-IR analyses verified the crystalline phase and elemental composition, focusing on nitrogen (N) and phosphorus (P2O5), important nutrients for crops. SEM and microscopy further demonstrated the excellent quality of the final product. Our results suggest that untreated Moroccan phosphoric acid can be effectively used to produce pure urea phosphate crystals, thus providing an effective solution for improving agricultural productivity.
摩洛哥是世界上主要的磷酸盐生产国之一,将其磷酸盐储备转化为磷酸,磷酸进一步用于生产磷酸脲。磷酸脲是植物生长所需氮和磷的重要来源。然而,摩洛哥的磷酸净化是确保高质量磷酸脲生产的关键。在本研究中,我们在优化的条件下,通过尿素和磷酸的放热反应合成了磷酸脲,反应时间为90min。60 min后开始结晶体,90 min后取终样。元素和形态分析证实了合成的磷酸脲晶体的高纯度。XRD和FT-IR分析验证了晶体相和元素组成,重点分析了作物的重要营养物质氮(N)和磷(P2O5)。扫描电镜和显微镜进一步证明了最终产品的优良质量。我们的研究结果表明,未经处理的摩洛哥磷酸可以有效地用于生产纯磷酸脲晶体,从而为提高农业生产力提供了有效的解决方案。
{"title":"Comparative study on early and late-stage crystallization of urea phosphate from untreated Moroccan phosphoric acid","authors":"Ayoub Cherrat (Conceptualization Data curation Formal analysis Funding acquisition Investigation Methodology Project administration Resources Software Supervision Validation Visualization Writing – original draft Writing – review & editing) ,&nbsp;Yassine Ennaciri (Formal analysis) ,&nbsp;Aziz Azifa (Formal analysis) ,&nbsp;El Mostafa Erradi (Formal analysis) ,&nbsp;Boujemaa Drif (Formal analysis) ,&nbsp;Mohamed Oubaouz (Formal analysis) ,&nbsp;Niraka Blaise (Formal analysis) ,&nbsp;Hicham El Ossmani (Formal analysis) ,&nbsp;Najoua Labjar (Methodology Resources) ,&nbsp;H. El Alaoui-Belghiti (Software) ,&nbsp;Souad El Hajjaji (Validation Visualization) ,&nbsp;Mohammed Bettach (Methodology Validation Visualization)","doi":"10.1080/10426507.2025.2517258","DOIUrl":"10.1080/10426507.2025.2517258","url":null,"abstract":"<div><div>Morocco is one of the world’s leading phosphate producers, converting its phosphate reserves into phosphoric acid, which is further used to produce urea phosphate. Urea phosphate is a valuable source of nitrogen and phosphorus for plant growth. However, phosphoric acid purification in Morocco is crucial to ensure high-quality urea phosphate production. In this study, we synthesized urea phosphate <em>via</em> an exothermic reaction of urea and phosphoric acid under optimized conditions for 90 min. Crystals began to form after 60 min, and the final sample was taken after 90 min. Elemental and morphological analyses confirmed the high purity of the synthesized urea phosphate crystals. XRD and FT-IR analyses verified the crystalline phase and elemental composition, focusing on nitrogen (N) and phosphorus (P<sub>2</sub>O<sub>5</sub>), important nutrients for crops. SEM and microscopy further demonstrated the excellent quality of the final product. Our results suggest that untreated Moroccan phosphoric acid can be effectively used to produce pure urea phosphate crystals, thus providing an effective solution for improving agricultural productivity.</div></div>","PeriodicalId":20056,"journal":{"name":"Phosphorus, Sulfur, and Silicon and the Related Elements","volume":"200 7","pages":"Pages 552-564"},"PeriodicalIF":1.4,"publicationDate":"2025-07-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144588127","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Design, synthesis, X-ray crystal structure and antibacterial activity of ferulic acid derivatives bearing sulfonamide moiety 含磺胺片段阿魏酸衍生物的设计、合成、x射线晶体结构及抗菌活性
IF 1.4 4区 化学 Q4 CHEMISTRY, INORGANIC & NUCLEAR Pub Date : 2025-07-03 Epub Date: 2025-06-11 DOI: 10.1080/10426507.2025.2517257
Song Bai (Conceptualization Funding acquisition Investigation Resources Supervision Writing – review & editing) , Suran Wan (Conceptualization Funding acquisition Investigation Methodology Resources Writing – original draft Writing – review & editing) , Rong Wu (Conceptualization Investigation Methodology Resources) , Miao Li (Conceptualization Data curation Investigation Methodology) , Fang Wang (Conceptualization Investigation Methodology) , Shouying Tang (Conceptualization Investigation Methodology) , Lijun Chen (Conceptualization Data curation Investigation Project administration) , Xian Wei (Conceptualization Investigation) , Shuang Feng (Conceptualization Investigation) , Miaohe Zhang (Conceptualization Investigation)
A total of 28 new ferulic acid derivatives bearing the sulfonamide moiety were designed and synthesized, followed by an evaluation of their antibacterial activities. The structures of the synthesized compounds (B1 − B28) were fully characterized using 1H NMR,13C NMR, and HRMS techniques. Among them, the structure of compound B11 was further elucidated through X-ray single-crystal diffraction analyses. Bioassay results indicated that several target compounds exhibited significant inhibitory activity against the tested plant pathogens in vitro. Notably, compound B28 demonstrated the highest resistance to Xanthomonas oryzae pv. oryzicola (Xoc), with an EC50 (half-maximal effective concentration) value of 28.6 μg/mL, which was more than twice as effective as the control agents zinc thiazole (EC50 = 74.4 μg/mL) and thiodiazole copper (EC50 = 97.1 μg/mL). Mechanistic studies revealed that B28 enhances bacterial membrane permeability and disrupts cell morphology. This work highlights promising candidates for agricultural antibacterial applications.
设计合成了28个含磺胺基团的阿魏酸衍生物,并对其抑菌活性进行了评价。利用1H NMR、13C NMR和HRMS技术对合成的化合物(B1−B28)进行了结构表征。其中,化合物B11的结构通过x射线单晶衍射分析得到了进一步的阐明。生物实验结果表明,几种目标化合物对植物病原菌具有明显的体外抑制活性。值得注意的是,化合物B28对水稻黄单胞菌的抗性最高。oryzicola (Xoc)的EC50(半最大有效浓度)值为28.6 μg/mL,是对照剂噻唑锌(EC50 = 74.4 μg/mL)和噻唑铜(EC50 = 97.1 μg/mL)的2倍以上。机制研究表明B28增强细菌膜通透性,破坏细胞形态。这项工作突出了农业抗菌应用的有前途的候选者。
{"title":"Design, synthesis, X-ray crystal structure and antibacterial activity of ferulic acid derivatives bearing sulfonamide moiety","authors":"Song Bai (Conceptualization Funding acquisition Investigation Resources Supervision Writing – review & editing) ,&nbsp;Suran Wan (Conceptualization Funding acquisition Investigation Methodology Resources Writing – original draft Writing – review & editing) ,&nbsp;Rong Wu (Conceptualization Investigation Methodology Resources) ,&nbsp;Miao Li (Conceptualization Data curation Investigation Methodology) ,&nbsp;Fang Wang (Conceptualization Investigation Methodology) ,&nbsp;Shouying Tang (Conceptualization Investigation Methodology) ,&nbsp;Lijun Chen (Conceptualization Data curation Investigation Project administration) ,&nbsp;Xian Wei (Conceptualization Investigation) ,&nbsp;Shuang Feng (Conceptualization Investigation) ,&nbsp;Miaohe Zhang (Conceptualization Investigation)","doi":"10.1080/10426507.2025.2517257","DOIUrl":"10.1080/10426507.2025.2517257","url":null,"abstract":"<div><div>A total of 28 new ferulic acid derivatives bearing the sulfonamide moiety were designed and synthesized, followed by an evaluation of their antibacterial activities. The structures of the synthesized compounds (<strong>B1 − B28</strong>) were fully characterized using <sup>1</sup>H NMR,<sup>13</sup>C NMR, and HRMS techniques. Among them, the structure of compound <strong>B11</strong> was further elucidated through X-ray single-crystal diffraction analyses. Bioassay results indicated that several target compounds exhibited significant inhibitory activity against the tested plant pathogens <em>in vitro</em>. Notably, compound <strong>B28</strong> demonstrated the highest resistance to <em>Xanthomonas oryzae</em> pv. <em>oryzicola</em> (<em>Xoc</em>), with an EC<sub>50</sub> (half-maximal effective concentration) value of 28.6 <em>μ</em>g/mL, which was more than twice as effective as the control agents zinc thiazole (EC<sub>50</sub> = 74.4 <em>μ</em>g/mL) and thiodiazole copper (EC<sub>50</sub> = 97.1 <em>μ</em>g/mL). Mechanistic studies revealed that <strong>B28</strong> enhances bacterial membrane permeability and disrupts cell morphology. This work highlights promising candidates for agricultural antibacterial applications.</div></div>","PeriodicalId":20056,"journal":{"name":"Phosphorus, Sulfur, and Silicon and the Related Elements","volume":"200 7","pages":"Pages 569-577"},"PeriodicalIF":1.4,"publicationDate":"2025-07-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144587453","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
期刊
Phosphorus, Sulfur, and Silicon and the Related Elements
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