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New discoveries in chemical research and development in 2021. In classical electrochemical theory, both the electron transfer rate and the adsorption of reactants at the electrode control the electrochemical reaction. 367-11-3, Name is 1,2-Difluorobenzene, molecular formula is C6H4F2. In an article, author is Bozdag, Murat,once mentioned of 367-11-3, Product Details of 367-11-3.

2-Mercaptobenzoxazole is a widely used organic scaffold in medicinal chemistry. By means of kinetic and structural studies, we demonstrate that this molecule can effectively be used to inhibit hCAs showing a peculiar binding mode. The results reported here can pave the way for the development of selective CA inhibitors.

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Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

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Research speed reading in 2021. Catalysts allow a reaction to proceed that has a lower activation energy than the uncatalyzed reaction. In heterogeneous catalysis, catalysts provide a surface to which reactants bind in a process of adsorption. 367-11-3, Name is 1,2-Difluorobenzene, molecular formula is , belongs to benzoxazole compound. In a document, author is Pino-Cuevas, Arantxa, Recommanded Product: 367-11-3.

Nine thiosemicarbazone ligands (H2Ln, n = 1-9) containing benzothiazole or benzoxazole groups at the C(2) atom of the thiosemicarbazone have been prepared and characterized. A crystal structure study was performed on six of these free ligands and the role of the pi-pi interactions in the molecular association was analyzed. The coordination behavior of the thiosemicarbazones towards the {Re(CO)(3)}(+) fragment was investigated and three types of complexes were obtained: mononuclear fac-[ReX(H(2)Ln)(CO)(3)], X = Cl or Br, with bidentate ligands, dinuclear [Re-2(HLn)(2)(CO)(6)] with monodeprotonated bridging thiosemicarbazonates yielding Re2S2 cores and tetranuclear [Re-4(L-2)(2)(CO)(12)(EtOH)(2)] with an unusual bideprotonated thiosemicarbazonate ligand. The intermolecular interactions before and after metal coordination were analyzed. In the dinuclear complexes, two different approximate symmetries were observed depending on the relative orientation of the thiosemicarbazonate ligands with respect to the Re2S2 diamond. The intramolecular interactions in the dimers and their relationship with the two possible symmetric dispositions were analyzed. The findings, in conjunction with theoretical calculations, allowed the main stabilizing factors for each type of symmetry to be elucidated.

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Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

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New discoveries in chemical research and development in 2021. As an important bridge between the micro, chemistry is one of the main methods and means for humans to understand and transform the material world. In an article, author is Wang, Cong, once mentioned the application of 367-11-3, Reference of 367-11-3, category is benzoxazole. Now introduce a scientific discovery about this category.

The PCN pincer Pd(II) complexes 4a-c with (phosphinito)aryl benzimidazole ligands were conveniently synthesized by one-pot phosphorylation/palladation reaction of a (2-benzimidazolyl)-containing m-phenol derivative 3. The three complexes were well characterized by spectroscopic methods, elemental analysis and their molecular structures were further determined by X-ray single-crystal diffraction. The Pd(II) center in each complex adopts a typical distorted-square-planar geometry. With a catalyst loading of 0.25-0.5 mol%, complex 4a could effectively catalyze C-H arylation of benzothiazole, benzoxazole and thiazole with various aryl iodides in the presence of Cul as a cocatalyst. (C) 2017 Elsevier Ltd. All rights reserved.

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Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

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New research progress on 367-11-3 in 2021.Chemistry is a science major with cience and engineering. The main research directions are chemical synthesis, new energy materials, preparation and modification of special coatings. 367-11-3, Name is 1,2-Difluorobenzene, molecular formula is , belongs to benzoxazole compound. In a document, author is Jin, Xilang, Safety of 1,2-Difluorobenzene.

Specifically, visually, and quantitatively monitor copper ion (Cu2+) is critical in the area of biological and environmental detection. Herein, a ratiometric fluorescent probe with benzoxazole appended xanthenes skeleton was constructed and further employed to monitor Cu2+ in Hela cells, real water samples, and test strips. An easily distinguishable colorimetric (colorless to red) and fluorescence (green to red) change could be observed by naked eye under the portable UV lamp (365 nm) and the changes could be recovered by adding S-2. Furthermore, electrospinning technique was employed to fabricate a probe composited fluorescent sensing film (PMMA) for realizing the visual and recyclable monitoring of Cu2+, indicating that the probe-composited fluorescent sensing film has great potential for on-site and naked-eye detection of Cu2+ in practical. (C) 2020 Elsevier B.V. All rights reserved.

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Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

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Chemistry is the experimental and theoretical study of materials on their properties at both the macroscopic and microscopic levels. 367-11-3, Name is 1,2-Difluorobenzene, molecular formula is C6H4F2. In an article, author is Erol, Meryem,once mentioned of 367-11-3, HPLC of Formula: https://www.ambeed.com/products/367-11-3.html.

Synthesis, Molecular Docking, and DFT Studies of Some New 2,5-Disubstituted Benzoxazoles as Potential Antimicrobial and Cytotoxic Agents

In this study, a total of 17 piece 2,5-disubstituted benzoxazole derivatives were synthesized, 2 of which were not original, their antimicrobial activities were determined using microdilution method and theirin vitrocytotoxic activities were investigated on MCF-7 and A549 cells by MTT test. When the activity results are examined, although the antibacterial effects of benzoxazole derivatives are weaker than standard drugs;3N13and3N19againstCandida albicansisolate showed the closest activity to fluconazole with MIC: 16 mu g/ml. The cytotoxicity test was measured at a concentration of 100 mu M and a 24-h incubation period. The results showed that the compounds had weak activities against two cell lines. Molecular docking studies of synthesized compounds were performed on sterol 14 alpha-demethylase protein (CYP51) and protein-ligand interactions of3N13, the most effective derivative againstC. albicansisolate, were showed (PDB: 5TZ1). Estimated ADME profiles of compounds were calculated and also3N13’s were calculated HUMO-LUMO energies, molecular electrostatic potential analysis, and geometric optimization parameters with 6-311 G+ (d,p) base set using DFT/B3LYP theory, and the results were displayed.

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Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

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Chemistry is the experimental science by definition. We want to make observations to prove hypothesis. For this purpose, we perform experiments in the lab. , Name: 1,2-Difluorobenzene, 367-11-3, Name is 1,2-Difluorobenzene, molecular formula is C6H4F2, belongs to benzoxazole compound. In a document, author is Peng, Jiang, introduce the new discover.

Light-Induced Bending of Needle-Like Crystals of Naphthylvinylbenzoxazole Triggered by trans-cis Isomerization

New diarylethene derivatives containing benzoxazole (NBO) and benzothiazole (NBT) have been synthesized. Light-induced trans-cis isomerization of NBO and NBT took place in crystals, and only induced the needle-like crystals of NBO to bend backwards away from the UV light source. The movement of the atoms was deemed to take place during the isomerization of NBO; hence, strain would be produced and accumulated rapidly in the surface of crystals exposed to UV light. The uniform release of strain led to the bending of needle-like crystals. The light-induced trans-cis isomerization efficiency of NBT was too low to drive the motion of crystals, which might have originated from the large repulsion between naphthyl and benzothiazole. These results provide a new platform for the transformation of light energy into mechanical energy in molecular crystals through the unimolecular photochemical reaction of diarylethene derivatives.

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Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

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Electric Literature of 367-11-3, Catalysts allow a reaction to proceed via a pathway that has a lower activation energy than the uncatalyzed reaction. 367-11-3, Name is 1,2-Difluorobenzene, SMILES is FC1=CC=CC=C1F, belongs to benzoxazole compound. In a article, author is De, Sourav, introduce new discover of the category.

Synthesis, characterisation, molecular docking, biomolecular interaction and cytotoxicity studies of novel ruthenium(II)-arene-2-heteroarylbenzoxazole complexes

In this article, Ru(II)-arene-2-pyridinylbenzoxazole complexes [(eta(6)-p-cymene)RuCl(kappa(2)-N,N-5-bromo-2-(pyridine-2-yl)benzo[d]oxazole)] (4) and [(eta(6)-benzene)RuCl(kappa(2)-N,N-5-bromo-2-(pyridine-2-yl)benzo[d]oxazole)] (5) and Ru(II)-arene-2-quinolylbenzoxazole complexes [(eta(6)-p-cymene)RuCl(kappa(2)-N,N-5-bromo-2-(quinoline-2-yl)benzo[d]oxazole)] (4′) and [(eta(6)-benzene)RuCl(kappa(2)-N,N-5-bromo-2-(quinoline-2-yl)benzo[d]oxazole)] (5′) were synthesized and characterized using various spectroscopic techniques. Structural analysis indicates that the Ru(II) centres are in a distinct mononuclear, one-sided octahedral [RuN6] coordination geometry with two neutral bidentate nitrogen donors in the bromobenzoxazole ligands. All four complexes exhibit three different electronic bands: a sharp band at 300-330 nm due to ligand-to-ligand charge transfer (LLCT); a band around 400 nm due to metal-to-ligand charge transfer; and a small broad peak at around 600 nm due to ligand-to-metal charge transfer. The fluorescence abilities of the four complexes were studied using the LLCT absorption peak as the excitation energy in dimethylsulfoxide: water (1:1, v/v), and the quantum yield was found to decrease in the order of 5′ > 4′ > 4 > 5. Density functional theory calculations reveal that the highest-occupied molecular orbital is primarily located on the benzoxazole ring system, while the lowest-unoccupied molecular orbital is mainly located on the Ru atom, which implies possible charge transfer from ligand to metal. The binding strengths of the Ru(II) complexes with DNA (5′ > 4′ > 4 > 5) and bovine serum albumin (4′ > 5′ > 5 > 4) were on the order of 10(5)-10(6) and 10(3)-10(5) M-1, respectively. The conductometric data reveal that all four complexes are non-electrolytic in nature, and viscosity decreases in the order of 5′ > 4′ > 4 > 5. This might be due to the effective intercalation of 5 compared to the other complexes. DNA and protein docking studies suggest that all the complexes interact with DNA through the minor groove and favourably occupy the active sites of proteins based on dipole-dipole interactions. Gel electrophoresis studies show that all complexes degrade plasmid DNA (1 kb) completely within 1 h of exposure time. MTT assay results indicate that all complexes exhibit highly selective cytotoxicity for two cancer cell lines (Caco-2 and HeLa) with respect to normal HEK-293 cells. Among the complexes, 4 and 5 show the highest cytoselectivities for the Caco-2 and HeLa cell lines, respectively.

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Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

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Chemistry is the experimental and theoretical study of materials on their properties at both the macroscopic and microscopic levels. 367-11-3, Name is 1,2-Difluorobenzene, molecular formula is C6H4F2. In an article, author is Abdelgawad, Mohamed A.,once mentioned of 367-11-3, Category: benzoxazole.

New pyrimidine-benzoxazole/benzimidazole hybrids: Synthesis, antioxidant, cytotoxic activity, in vitro cyclooxygenase and phospholipase A2-V inhibition

To enhance the cytotoxicity of benzimidazole and/or benzoxazole core, the benzimidazole/benzoxazole azopyrimidine were synthesized through diazo-coupling of 3-aminophenybenzimidazole (6a) or 3-aminophenylbenzoxazole (6b) with diethyl malonate. The new azo-molanates 6a&b mixed with urea in sodium ethoxide to afford the benzimidazolo/benzoxazolopyrimidine 7a&b. The structure elucidation of new synthesized targets was proved using spectroscopic techniques NMR, IR and elemental analysis. The cytoxicity screening had been carried out against five cancer cell lines: prostate cancer (PC-3), lung cancer (A-549), breast cancer (MCF-7), pancreas cancer (PaCa-2) and colon cancer (HT-29). Furthermore, the antioxidant activity, phospholipase A2-V and cyclooxygenases inhibitory activities of the target compounds 7 aRrb were evaluated and the new compounds showed potent activity (cytotoxicity IC50 range from 4.3 to 9.2 mu m, antioxidant activity from 40% to 80%, COXs or LOX inhibitory activity from 1.92 mu M to 8.21 mu M). The docking of 7a&b was made to confirm the mechanism of action.

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Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

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Chemistry is an experimental science, Product Details of 367-11-3, and the best way to enjoy it and learn about it is performing experiments.Introducing a new discovery about 367-11-3, Name is 1,2-Difluorobenzene, molecular formula is C6H4F2, belongs to benzoxazole compound. In a document, author is Pino-Cuevas, Arantxa.

Structural study of mono-, di- and tetranuclear complexes of the {Re(CO)(3)}(+) fragment with thiosemicarbazone/thiosemicarbazonate ligands containing benzothiazole or benzoxazole groups

Nine thiosemicarbazone ligands (H2Ln, n = 1-9) containing benzothiazole or benzoxazole groups at the C(2) atom of the thiosemicarbazone have been prepared and characterized. A crystal structure study was performed on six of these free ligands and the role of the pi-pi interactions in the molecular association was analyzed. The coordination behavior of the thiosemicarbazones towards the {Re(CO)(3)}(+) fragment was investigated and three types of complexes were obtained: mononuclear fac-[ReX(H(2)Ln)(CO)(3)], X = Cl or Br, with bidentate ligands, dinuclear [Re-2(HLn)(2)(CO)(6)] with monodeprotonated bridging thiosemicarbazonates yielding Re2S2 cores and tetranuclear [Re-4(L-2)(2)(CO)(12)(EtOH)(2)] with an unusual bideprotonated thiosemicarbazonate ligand. The intermolecular interactions before and after metal coordination were analyzed. In the dinuclear complexes, two different approximate symmetries were observed depending on the relative orientation of the thiosemicarbazonate ligands with respect to the Re2S2 diamond. The intramolecular interactions in the dimers and their relationship with the two possible symmetric dispositions were analyzed. The findings, in conjunction with theoretical calculations, allowed the main stabilizing factors for each type of symmetry to be elucidated.

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Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

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One of the major reasons for studying chemical kinetics is to use measurements of the macroscopic properties of a system, such as the rate of change in the concentration of reactants or products with time. 367-11-3, Name is 1,2-Difluorobenzene, formurla is C6H4F2. In a document, author is Li, Zhengyu, introducing its new discovery. Safety of 1,2-Difluorobenzene.

One-Pot Synthesis of 3-Difluoromethyl Benzoxazole-2-thiones

A one-pot strategy for the diversified synthesis of 3-difluoromethyl benzoxazole-2-thiones is reported. The reaction of 2-aminophenol, sodium chlorodifluoroacetate, and elemental sulfur in the presence of NaOt-Bu gives exclusively 3-difluoromethyl benzoxazole-2-thiones in good yield (up to 98%). The mechanism of this reaction presumably involves first cyclization of 2-aminophenols with thiocarbonyl fluoride, followed by N-difluoromethylation with difluorocarbene. The developed synthetic procedures are versatile, robust, and easily scalable for the synthesis of 3-difluoromethyl benzoxazole-2-thione derivatives, some of which have shown insecticidal activities.

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Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem