Journal of the Iranian Chemical Society最新文献

{"title":"MOF-5 derived magnetic CuFe2O4@SiO2 nanocomposite for highly efficient and sustainable carboxylative cyclization of CO2 to α‑alkylidene cyclic carbonates","authors":"Yulin Hu,&nbsp;Qinyan Shen","doi":"10.1007/s13738-025-03173-4","DOIUrl":"10.1007/s13738-025-03173-4","url":null,"abstract":"<div><p>Carbon dioxide as a C1 building block to synthesize α-alkylidene cyclic carbonates is an environmental and sustainable approach. In this work, we designed and synthesized a multifunctional magnetic MOF nanocatalyst CuFe₂O₄@SiO₂@MOF-5, which could realize the carboxylic cyclization of CO₂ and propargylic alcohols into α-alkylidene cyclic carbonates in high to excellent yields under mild reaction conditions. More importantly, the nanocatalyst CuFe₂O₄@SiO₂@MOF-5 exhibited excellent reusability and could be recycled at least six times retaining its excellent catalytic activity as well as chemical stability. These findings may be useful for the rational design of heterogeneous and recyclable routes for the catalytic conversion of CO₂ to valuable chemicals.</p><h3>Graphical Abstract</h3>\u0000<div><figure><div><div><picture><source><img></source></picture></div></div></figure></div></div>","PeriodicalId":676,"journal":{"name":"Journal of the Iranian Chemical Society","volume":"22 3","pages":"657 - 666"},"PeriodicalIF":2.2,"publicationDate":"2025-01-16","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143581198","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}

{"title":"Rapid, simple and highly selective determination of Chromium(III) in aqueous samples by a microfluidic cell coupled to a smartphone-based colorimetric-sensing detector","authors":"Bahareh Moradifar,&nbsp;Abbas Afkhami,&nbsp;Tayyebeh Madrakian,&nbsp;Mohammad Reza Jalali Sarvestani,&nbsp;Sina Khalili","doi":"10.1007/s13738-025-03172-5","DOIUrl":"10.1007/s13738-025-03172-5","url":null,"abstract":"<div><p>In this study, citrate-modified Ag (AgNPs@Cit) plasmonic nanoparticles were synthesized and characterized using UV–visible spectrophotometry and transmission electron microscopy (TEM). Subsequently, a microfluidic kit was developed for the colorimetric point of care (POC) detection of Cr³⁺ based on the color change of AgNPs@Cit solution from yellow to red in the presence of Cr³⁺ ions. The experimental parameters were optimized using a central composite experimental design, and the interactions between operational factors were thoroughly examined. Under optimum conditions (flow rate: 0.04 mL/min, flow path length: 9.65 cm, and pH = 7.6), a linear relationship was established between the red component of RGB pixels of the analyzed images captured by a smartphone and the concentration of Cr³⁺ within the range of 1.00–35.00 µmol L⁻¹. The proposed method exhibited a detection limit of 0.33 µmol L⁻¹. The selectivity of the developed microfluidic kit was evaluated, and no significant interference was observed. Furthermore, the applicability of the suggested microfluidic kit for the determination of Cr³⁺ in five different drinking water samples was successfully demonstrated, with calculated recovery values falling within the range of 96.2–106.4%.</p></div>","PeriodicalId":676,"journal":{"name":"Journal of the Iranian Chemical Society","volume":"22 3","pages":"605 - 613"},"PeriodicalIF":2.2,"publicationDate":"2025-01-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://link.springer.com/content/pdf/10.1007/s13738-025-03172-5.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143581150","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

{"title":"A novel catalyst for the synthesis of 3–5-disubstituted isoxazole derivatives from aldoximes","authors":"Nesimi Uludag,&nbsp;Alper Sanlı","doi":"10.1007/s13738-024-03164-x","DOIUrl":"10.1007/s13738-024-03164-x","url":null,"abstract":"<div><p>An efficient new approach has been described for the synthesis of substituted isoxazole derivatives 3a-l from substituted aldoximes and diethyl acetylenedicarboxylate using NaNO₂ and AlCl₃ in one step in moderate to excellent yields (55–94%). The key nitrile <i>N-</i>oxide intermediates that are required for the synthesis of isoxazole derivatives are formed by treatment of substituted aldoxime with assisted discovery of its newer applications by successive treatment with NaNO₂. The generated nitrile oxides underwent [3 + 2] dipolar cycloaddition of alkynes over AlCl₃ as a Lewis acid. Moreover, this approach has considerably assisted in the discovery of its significant advantages. This strategy is creating a five-membered ring with an oxygen and nitrogen atom adjacent to each other as either catalyst or reagent. The structures of the synthesized compounds were confirmed by spectroscopic methods, and a mechanism was proposed.</p><h3>Graphical abstract</h3>\u0000<div><figure><div><div><picture><img></picture></div></div></figure></div></div>","PeriodicalId":676,"journal":{"name":"Journal of the Iranian Chemical Society","volume":"22 3","pages":"509 - 515"},"PeriodicalIF":2.2,"publicationDate":"2025-01-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://link.springer.com/content/pdf/10.1007/s13738-024-03164-x.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143581151","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

{"title":"Spectrophotometric trace determination of Fe(II) with 5,7-dibromo-8-hydroxyquinoline and investigating the spectral, antimicrobial, anticancer properties and DFT study of iron complexes","authors":"Kusum,&nbsp;Amita Garg,&nbsp; Sumit,&nbsp;Pawan Kumar,&nbsp;Jai Kumar","doi":"10.1007/s13738-024-03171-y","DOIUrl":"10.1007/s13738-024-03171-y","url":null,"abstract":"<div><p>A simple, selective and versatile spectrophotometric technique has been developed for determination of iron in novel complex of iron with 5,7-Dibromo-8-hydroxyquinoline in a basic medium. The green-colored complex was extractable in chloroform within the pH range of 8.95–8.99 with maximum intensity of color in the wavelength range of 429–439 nm. Analytical techniques confirmed the complex stoichiometry of 1:2 [Fe(II)-DBHQ]. Several parameters were also calculated like Sandell^’s sensitivity (0.001953 µg cm⁻²), molar absorptivity coefficient (2.849 × 10⁴ L mol⁻¹ cm⁻²), standard deviation of reproducibility (± 0.001048/0.205%), detection limit (0.14 µg/ml) and regression coefficient (0.9497). These parametric values showed higher adaptability, cost-effectiveness and higher sensitivity of the proposed method of complex determination as compared to already reported methods. Computational chemistry calculations were studied using DFT, and global reactivity descriptors such as electronegativity, softness, hardness, electron affinity, ionization potential and electrophilicity were estimated with HOMO and LUMO energies. Using MEP analysis possible targets for nucleophilic or electrophilic attacks on the chemical structures of the complex were identified. In vitro anticancer and antimicrobial activity of the complex was further determined, and the complex showed antineoplastic as well as antimicrobial potency, hence showed the novel complex compatibility in antimicrobial and anticancer applications like therapeutic agents and metal-based drugs.</p></div>","PeriodicalId":676,"journal":{"name":"Journal of the Iranian Chemical Society","volume":"22 3","pages":"589 - 603"},"PeriodicalIF":2.2,"publicationDate":"2025-01-12","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://link.springer.com/content/pdf/10.1007/s13738-024-03171-y.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143581229","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

{"title":"Synthesis, characterization and biological evaluation, determination of physico chemical parameters at three different temperatures and ADME studies of some 4-thiazolidinone containing furan and pyrimidine moiety","authors":"Umang P. Mehta,&nbsp;Dinesh R. Godhani,&nbsp;Anwar H. Saiyad,&nbsp;Kuldip P. Parmar,&nbsp;Jignasu P. Mehta","doi":"10.1007/s13738-024-03162-z","DOIUrl":"10.1007/s13738-024-03162-z","url":null,"abstract":"<div><p>We created a novel family of 5-benzylidene-2-(furan-2-yl)-3-(pyrimidin-2-yl)thiazolidin-4-one (5a-o) to successfully decrease viral diseases linked to antimicrobial resistance (AMR), which is a major public health problem worldwide. Using spectral approaches, the structures of the pertinent chemicals have been identified and confirmed. Compounds with chloro substituents in both the <i>p</i>-position and the <i>m</i>-position showed good activity against the fungi, products with the nitro group at the ring's <i>m</i>-position and methyl, bromo, and nitro substituents in the benzene ring's <i>p</i>-position showed very good activity against bacterial strains. <i>Aspergillus Niger</i> and <i>Fusarium Javanicum</i> In a binary liquid mixture containing 4-thiazolidinone derivatives containing furan and pyrimidine moiety over the whole molality range at temperatures T = (303.15, 308.15, 313.15 and 318.15) K and different solvents DMSO and DMF, density (<i>ρ</i>), ultrasonic velocity (<i>U</i>), and viscosity (<i>η</i>) have been measured.</p><h3>Graphical abstract</h3><div><figure><div><div><picture><source><img></source></picture></div></div></figure></div></div>","PeriodicalId":676,"journal":{"name":"Journal of the Iranian Chemical Society","volume":"22 3","pages":"475 - 497"},"PeriodicalIF":2.2,"publicationDate":"2025-01-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://link.springer.com/content/pdf/10.1007/s13738-024-03162-z.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143581138","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

{"title":"Europium activated bismuth containing double perovskite catalyzed synthesis of coumarin derivatives and its cytotoxicity evaluation","authors":"Dharmana Tejeswararao,&nbsp;Deepshikha Datta,&nbsp;Nagamani Naidu Bonnada,&nbsp;Bimal Das","doi":"10.1007/s13738-024-03161-0","DOIUrl":"10.1007/s13738-024-03161-0","url":null,"abstract":"<div><p>Using NaBaBi_1−<i>x</i>Eu_<i>x</i>MoO₆:Eu³⁺(<i>x</i> = 0.0–0.24) europium activated bismuth containing double perovskite materials, a novel heterogeneous catalytic procedure was developed to prepare coumarin and its modified coumarins. Double perovskite catalyst predicts great activity toward a wide range of phenols with variety of that have been substituted with ketoesters in precise yields over short response times during the production of coumarin. Standard protocols were used to prepare various coumarin derivatives, characterized by spectral techniques and eventually evaluated against COLO205, A549, THP-1, B16 and U937 human cancer cells. Compared to the standard drug Etoposide, hybrid <b>3f</b> demonstrated a higher affinity and better binding interactions with the above cancer cells. UV-fluorescence spectra were recorded for selected coumarin derivatives. However, it is stated here that these molecular hybrids of coumarin could serve as a great starting point for future research to create effective anticancer agents.</p></div>","PeriodicalId":676,"journal":{"name":"Journal of the Iranian Chemical Society","volume":"22 2","pages":"445 - 456"},"PeriodicalIF":2.2,"publicationDate":"2025-01-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143184718","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}

{"title":"Metal–organic framework functionalized with deep eutectic solvent as the efficient, green, reusable, and heterogeneous catalyst for one-pot three-component synthesis of pyrimido[1,2-a]benzimidazoles","authors":"Zahra Karami,&nbsp;Mohammad Mehdi Khodaei","doi":"10.1007/s13738-024-03159-8","DOIUrl":"10.1007/s13738-024-03159-8","url":null,"abstract":"<div><p>Deep eutectic solvents (DESs) depict a class of solvents including some features of their ionic liquid cousins – relatively wide liquid range, low vapor pressure, and non-flammability. Nonetheless, since DESs are liquid and their transportation and separation are inconvenient, a new method is suggested that the immobilization of DESs on appropriate support could be a feasible solution. Herein, a DES-supported catalyst was prepared. Initially, metal–organic framework (MOF), NH₂- MIL-101(Cr), was modified with D-( +)-ribonic γ-lactone (RL), as a class of carbohydrates (CHs), which prepares plenty of hydroxyl groups on the surface for stabilizing choline chloride (ChCl) via hydrogen bonding, based on DESs. NH₂-MIL-101-RL@ChCl with appealing qualities like thermal and chemical stability and reusable catalyst is utilized for the one-pot synthesis of pyrimido[1,2-a] benzimidazoles. Its great catalytic performance was related to a synergistic effect between active sites of NH₂-MIL-101-RL and ChCl. The hot filtration test of the catalyst confirmed the heterogeneous nature and structural stability of the hybrid system. The porous NH₂-MIL-101-RL@ChCl was characterized using FTIR, powder XRD, SEM, EDX elemental mapping, TGA, and BET techniques.</p></div>","PeriodicalId":676,"journal":{"name":"Journal of the Iranian Chemical Society","volume":"22 2","pages":"419 - 431"},"PeriodicalIF":2.2,"publicationDate":"2025-01-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143184717","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}

{"title":"Investigation of the anti-leishmanial potential of triazole-linked carvacrol–coumarin derivatives: a docking, molecular dynamics, MM/GBSA toxicity approach","authors":"Caio Henrique Alexandre Roberto,&nbsp;Damião Sampaio de Sousa,&nbsp;Francisco Rogenio da Silva Mendes,&nbsp;Lorena Mayana Beserra de Oliveira,&nbsp;Alexandre Magno Rodrigues Teixeira,&nbsp;Hélcio Silva dos Santos,&nbsp;Emmanuel Silva Marinho","doi":"10.1007/s13738-024-03166-9","DOIUrl":"10.1007/s13738-024-03166-9","url":null,"abstract":"<div><p>Leishmaniasis is a neglected disease in tropical and subtropical regions caused by obligate intracellular parasitic protozoa of the genus <i>Leishmania ssp</i>, which can infect humans and animals. In the search for new drugs to treat leishmaniasis, natural compounds have emerged as therapeutic alternatives, such as carvacrol and coumarins, which are considered valuable therapeutic agents and intermediates for organic syntheses associated with other pharmacophores such as triazoles, coumarins, alkyl groups to in improve in pharmacological in properties. This study aims to evaluate the potential of hybrid compounds of coumarins and carvacrol associated with triazole pharmacophores by analyzing the influence of the aliphatic carbon chain and their interactions with the enzyme <i>N</i>-myristoyltransferase (NMT) of <i>Leishmania spp</i>. using in silico methods. It was observed that the Tc1 ligand showed superior affinity with the NMT protein, establishing interactions with residues in the same region as the crystallized inhibitor, and showed better affinity compared to the coumarin and carvacrol. Molecular dynamics simulations analyze the stability and free binding energy (∆<i>G</i>_bind) of the Tc1-NMT complex over 200 ns. The RMSD indicated system remained stable, with ∆<i>G</i>_bind of  − 33.80 kcal/mol. These results provide insights into a possible mechanism of inhibition of the natural product-derived Tc1 ligand toward the NMT transferase enzyme, which plays a vital role in the protozoan life cycle. The hybrids exhibited a low toxicity profile in rats, primarily via the oral route, commonly used in pre-clinical trials.</p><h3>Graphical abstract</h3>\u0000<div><figure><div><div><picture><source><img></source></picture></div><div><p>Triazole conjugated carvacrol–coumarin derivatives with anti-leishmanial potential</p></div></div></figure></div></div>","PeriodicalId":676,"journal":{"name":"Journal of the Iranian Chemical Society","volume":"22 3","pages":"459 - 473"},"PeriodicalIF":2.2,"publicationDate":"2025-01-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://link.springer.com/content/pdf/10.1007/s13738-024-03166-9.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143581113","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

{"title":"Correction to Synthesis of MOF‑70 based on diffusion method; microgram amount application as a highly efficient sorbent in dispersive micro solid phase extraction prior to dispersive liquid–liquid microextraction for the preconcentration and extraction of pesticides from fruit juices","authors":"Sakha Pezhhanfar,&nbsp;Mir Ali Farajzadeh,&nbsp;Seyed Abolfazl Hosseini‑Yazdi,&nbsp;Mohammad Reza Afshar Mogaddam","doi":"10.1007/s13738-024-03140-5","DOIUrl":"10.1007/s13738-024-03140-5","url":null,"abstract":"","PeriodicalId":676,"journal":{"name":"Journal of the Iranian Chemical Society","volume":"22 2","pages":"457 - 458"},"PeriodicalIF":2.2,"publicationDate":"2025-01-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143184691","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}

{"title":"Synthesis and characterization of SiO2/GO/Al2O3 nanocomposite adsorbent for the uptake of ciprofloxacin: isothermal and reusability studies","authors":"Prerna Higgins,&nbsp;Rajeev Kumar,&nbsp;Shaziya H. Siddiqui","doi":"10.1007/s13738-024-03158-9","DOIUrl":"10.1007/s13738-024-03158-9","url":null,"abstract":"<div><p>Silicon dioxide/graphene oxide/aluminum oxide (SiO₂/GO/Al₂O₃) nanocomposite was prepared for the ciprofloxacin (CPF) drug adsorption. The characterization techniques involving field-emission-scanning-electron-microscopy (FE-SEM) determined the topography of the nanocomposite and high resolution transmission electron microscopy (HR-TEM) determined the particle size for SiO₂/GO/Al₂O₃. The EDX confirmed the elemental composition of the materials incorporated, while the X-RD analysis inferred the crystalline nature of SiO₂/GO/Al₂O₃. The FT-IR analysis showcased the role of the capping groups involved. The present study focuses on the adsorption of ciprofloxacin (CPF) drug onto SiO₂/GO/Al₂O₃ regarding kinetics, isotherm, thermodynamics studies, and factors, such as solution pH, temperature, concentration, and time. The outcome showed that the highest adsorption of CPF was observed onto the SiO₂/GO/Al₂O₃ composite at pH 6.0. Similarly, the utmost adsorptive capacity of 499.44 mg g⁻¹ was achieved in 180 min and 500 mgL⁻¹ CPF solution concentration. The CPF uptake on SiO₂/GO/Al₂O₃ was in coordination with the pseudo-second-order equation and Langmuir isotherm, respectively. The thermodynamic parameters ciphered that the uptake of the CPF drug was spontaneous. The drug was easily desorbed using 0.1 M (aq) ethanol solution for six adsorption–desorption cycles.</p></div>","PeriodicalId":676,"journal":{"name":"Journal of the Iranian Chemical Society","volume":"22 2","pages":"407 - 418"},"PeriodicalIF":2.2,"publicationDate":"2025-01-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143184692","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}