Category: 99-04-7

An article Nitroxyl Catalysts for Six-Membered Ring Bromolactonization and Intermolecular Bromoesterification of Alkenes with Carboxylic Acids WOS:000643163800004 published article about ASYMMETRIC ALLYLATION; ENANTIOSELECTIVE ALLYLATION; N-OXIDE; ALDEHYDES; BROMOCYCLIZATION; ORGANOCATALYSTS; HALOGENATION; OXIDATION; ALLYLTRICHLOROSILANES; N,N’-DIOXIDE in [Moriyama, Katsuhiko; Kuramochi, Masako; Fujii, Kozo; Morita, Takeshi] Chiba Univ, Grad Sch Sci, Dept Chem, Chiba 2638522, Japan; [Moriyama, Katsuhiko; Kuramochi, Masako; Fujii, Kozo; Morita, Takeshi] Chiba Univ, Soft Mol Activat Res Ctr, Chiba 2638522, Japan; [Tsuzuki, Seiji] Natl Inst Adv Ind Sci & Technol, Nanosyst Res Inst NRI, Res Initiat Computat Sci RICS, Ibaraki 3058568, Japan in 2021.0, Cited 70.0. The Name is 3-Methylbenzoic acid. Through research, I have a further understanding and discovery of 99-04-7. Computed Properties of C8H8O2

We developed a nitroxyl-catalyzed bromoesterification of alkenes with bromo reagents, which includes a six-membered ring bromolactonization of alkenyl carboxylic acids catalyzed by AZADO as the nitroxyl radical catalyst, and an intermolecular bromoesterification of alkenes with carboxylic acids using NMO as the N-oxide catalyst. We also accomplished a remote diastereoselective bromohydroxylation via an AZADO-catalyzed six-membered ring bromolactonization and a subsequent ring cleavage reaction with alkylamines to furnish epsilon-bromo-delta-hydroxy amides with high diastereoselectivity.

Computed Properties of C8H8O2. About 3-Methylbenzoic acid, If you have any questions, you can contact Moriyama, K; Kuramochi, M; Tsuzuki, S; Fujii, K; Morita, T or concate me.

Reference:
Isothiazole – Wikipedia,
,Isothiazole – ScienceDirect.com

Application In Synthesis of 3-Methylbenzoic acid. Authors Marrazzini, G; Giovannini, T; Egidi, F; Cappelli, C in AMER CHEMICAL SOC published article about in [Marrazzini, Gioia; Egidi, Franco; Cappelli, Chiara] Scuola Normale Super Pisa, I-56126 Pisa, Italy; [Giovannini, Tommaso] Norwegian Univ Sci & Technol, Dept Chem, N-7491 Trondheim, Norway in 2020, Cited 94. The Name is 3-Methylbenzoic acid. Through research, I have a further understanding and discovery of 99-04-7

We present a computational study of polarizabilities and hyperpolarizabilities of organic molecules in aqueous solutions, focusing on solute-water interactions and the way they affect a molecule’s linear and non-linear electric response properties. We employ a polarizable quantum mechanics/molecular mechanics (QM/MM) computational model that treats the solute at the QM level while the solvent is treated classically using a force field that includes polarizable charges and dipoles, which dynamically respond to the solute’s quantum-mechanical electron density. Quantum confinement effects are also treated by means of a recently implemented method that endows solvent molecules with a parametric electron density, which exerts Pauli repulsion forces upon the solute. By applying the method to a set of aromatic molecules in solution we show that, for both polarizabilities and first hyperpolarizabilities, observed solution values are the result of a delicate balance between electrostatics, hydrogen-bonding, and non-electrostatic solute solvent interactions.

About 3-Methylbenzoic acid, If you have any questions, you can contact Marrazzini, G; Giovannini, T; Egidi, F; Cappelli, C or concate me.. Application In Synthesis of 3-Methylbenzoic acid

Reference:
Isothiazole – Wikipedia,
,Isothiazole – ScienceDirect.com

SDS of cas: 99-04-7. I found the field of Chemistry very interesting. Saw the article Chiral Bicyclic Imidazole-Catalyzed Acylative Dynamic Kinetic Resolution for the Synthesis of Chiral Phthalidyl Esters published in 2021, Reprint Addresses Zhang, WB (corresponding author), Shanghai Jiao Tong Univ, Shanghai Key Lab Mol Engn Chiral Drugs, Sch Pharm, 800 Dongchuan Rd, Shanghai 200240, Peoples R China.; Zhang, WB (corresponding author), Shanghai Jiao Tong Univ, Sch Chem & Chem Engn, Frontiers Sci Ctr Transformat Mol, 800 Dongchuan Rd, Shanghai 200240, Peoples R China.. The CAS is 99-04-7. Through research, I have a further understanding and discovery of 3-Methylbenzoic acid.

Utilizing a chiral bicyclic imidazole organocatalyst and adopting a continuous injection process, an alternative route has been developed for the efficient synthesis of chiral phthalidyl ester prodrugs via dynamic kinetic resolution of 3-hydroxyphthalides through enantioselective acylation (up to 99 % ee). The computational studies suggest a general base catalytic mechanism differing from the widely accepted nucleophilic catalytic mechanism. The structure analysis of the key transition states shows that the CH-pi interactions and not the previously considered cation/pi-pi interactions between the catalyst and substrate is the dominant factor giving rise to the observed stereocontrol.

SDS of cas: 99-04-7. About 3-Methylbenzoic acid, If you have any questions, you can contact Zhou, MX; Gridneva, T; Zhang, ZF; He, ED; Liu, YG; Zhang, WB or concate me.

Reference:
Isothiazole – Wikipedia,
,Isothiazole – ScienceDirect.com

Authors Tan, FF; He, XY; Tian, WF; Li, Y in NATURE RESEARCH published article about in [Tan, Fang-Fang; He, Xiao-Ya; Tian, Wan-Fa; Li, Yang] Xi An Jiao Tong Univ, Frontier Inst Sci & Technol, Xian 710054, Shaanxi, Peoples R China; [Tan, Fang-Fang; He, Xiao-Ya; Tian, Wan-Fa; Li, Yang] Xi An Jiao Tong Univ, State Key Lab Multiphase Flow Power Engn, Xian 710054, Shaanxi, Peoples R China; [Li, Yang] Nankai Univ, State Key Lab Elementoorgan Chem, Tianjin 300071, Peoples R China in 2020, Cited 69. SDS of cas: 99-04-7. The Name is 3-Methylbenzoic acid. Through research, I have a further understanding and discovery of 99-04-7

Cleavage of C-O bonds in lignin can afford the renewable aryl sources for fine chemicals. However, the high bond energies of these C-O bonds, especially the 4-O-5-type diaryl ether C-O bonds (similar to 314 kJ/mol) make the cleavage very challenging. Here, we report visible-light photoredox-catalyzed C-O bond cleavage of diaryl ethers by an acidolysis with an aryl carboxylic acid and a following one-pot hydrolysis. Two molecules of phenols are obtained from one molecule of diaryl ether at room temperature. The aryl carboxylic acid used for the acidolysis can be recovered. The key to success of the acidolysis is merging visible-light photoredox catalysis using an acridinium photocatalyst and Lewis acid catalysis using Cu (TMHD)(2). Preliminary mechanistic studies indicate that the catalytic cycle occurs via a rare selective electrophilic attack of the generated aryl carboxylic radical on the electron-rich aryl ring of the diphenyl ether. This transformation is applied to a gram-scale reaction and the model of 4-O-5 lignin linkages.

About 3-Methylbenzoic acid, If you have any questions, you can contact Tan, FF; He, XY; Tian, WF; Li, Y or concate me.. SDS of cas: 99-04-7

Reference:
Isothiazole – Wikipedia,
,Isothiazole – ScienceDirect.com

An article Palladium-Catalyzed N-Acylation of Tertiary Amines by Carboxylic Acids: A Method for the Synthesis of Amides WOS:000551552600046 published article about C-H; CROSS-COUPLINGS; AMMONIUM-SALTS; ALKYL-HALIDES; BOND; ACTIVATION; AMIDATION; DECARBONYLATION; ORGANOBORANES; CLEAVAGE in [Li, Zhaohui; Liu, Long; Xu, Kaiqiang; Huang, Tianzeng; Li, Xinyi; Song, Bin; Chen, Tieqiao] Hainan Univ, Hainan Prov Fine Chem Engn Res Ctr, Hainan Prov Key Lab Fine Chem, Key Lab,Minist Educ Adv Mat Trop Isl Resources, Haikou 570228, Hainan, Peoples R China in 2020, Cited 54. Quality Control of 3-Methylbenzoic acid. The Name is 3-Methylbenzoic acid. Through research, I have a further understanding and discovery of 99-04-7

A palladium-catalyzed N-acylation of tertiary amines by carboxylic acids was achieved through C-N cleavage. This reaction showed a wide substrate scope. Both aromatic and aliphatic acids served well as the acylating reagents and coupled with tertiary amines to produce the corresponding amides in good to excellent yields. With the strategy, bioactive carboxylic acids were also efficiently modified, highlighting the synthetic value of the process in organic synthesis.

About 3-Methylbenzoic acid, If you have any questions, you can contact Li, ZH; Liu, L; Xu, KQ; Huang, TZ; Li, XY; Song, B; Chen, TQ or concate me.. Quality Control of 3-Methylbenzoic acid

Reference:
Isothiazole – Wikipedia,
,Isothiazole – ScienceDirect.com

Authors Kalsi, D; Barsu, N; Chakrabarti, S; Dahiya, P; Rueping, M; Sundararaju, B in ROYAL SOC CHEMISTRY published article about HECK REACTIONS; FUNCTIONALIZATION; ACTIVATION; ARYLATION; RHODIUM; ALKYNES; ARENES; OXYGEN; SCOPE in [Kalsi, Deepti; Barsu, Nagaraju; Chakrabarti, Sagnik; Dahiya, Pardeep; Sundararaju, Basker] Indian Inst Technol Kanpur, Dept Chem, Kanpur 208016, Uttar Pradesh, India; [Rueping, Magnus] Rhein Westfal TH Aachen, Inst Organ Chem, Landoltweg 1, D-52074 Aachen, Germany in 2019, Cited 64. Safety of 3-Methylbenzoic acid. The Name is 3-Methylbenzoic acid. Through research, I have a further understanding and discovery of 99-04-7

A mild, environment-friendly protocol has been developed to carry out the [4+2] annulation of aryl amides with unactivated olefins. A range of sterically and electronically diverse aryl amides and unactivated olefins were successfully employed under the developed conditions to get a variety of dihydroisoquinolinones in good-to-excellent yields.

Safety of 3-Methylbenzoic acid. About 3-Methylbenzoic acid, If you have any questions, you can contact Kalsi, D; Barsu, N; Chakrabarti, S; Dahiya, P; Rueping, M; Sundararaju, B or concate me.

Reference:
Isothiazole – Wikipedia,
,Isothiazole – ScienceDirect.com

I found the field of Chemistry; Physics very interesting. Saw the article Abraham model correlations for solute transfer into benzyl alcohol from both water and the gas phase published in 2020.0. Formula: C8H8O2, Reprint Addresses Acree, WE (corresponding author), Univ North Texas, Dept Chem, 1155 Union Circle Dr 305070, Denton, TX 76203 USA.. The CAS is 99-04-7. Through research, I have a further understanding and discovery of 3-Methylbenzoic acid

Experimental solubilities have been determined for anthracene, benzil, 2-chloroanthraquinone, 9-fluorenone, 2-hydroxybenzoic acid, 2-methoxybenzoic acid, 2-methylbenzoic acid, 3-methylbenzoic acid, phenothiazine, pyrene, and thioxanthen-9-one dissolved in benzyl alcohol at 298.15 K. The measured solubility data, combined with previously published activity coefficient and solubility data, are used to determine Abraham model correlations for solute transfer to benzyl alcohol from both water and from the gas phase. The derived Abraham model correlations were found to back-calculate the experimental partition coefficients and solubility ratios to within 0.14 log units (or less).

Formula: C8H8O2. About 3-Methylbenzoic acid, If you have any questions, you can contact Fischer, R; Jodray, M; Qian, E; Wang, L; Lee, G; Yue, D; Che, M; Liu, YQ; Acree, WE; Abraham, MH or concate me.

Reference:
Isothiazole – Wikipedia,
,Isothiazole – ScienceDirect.com

SDS of cas: 99-04-7. Recently I am researching about FLUORINATED GRAPHENE; SENSING PROPERTIES; NANOCOMPOSITE; FABRICATION; ADSORPTION; TRANSPARENT; SENSITIVITY; COVALENT; SYSTEMS; FILMS, Saw an article supported by the Government of India by World BankThe World Bank India. Published in ELSEVIER SCIENCE SA in LAUSANNE ,Authors: Kumar, R; Kumar, A; Singh, R; Kashyap, R; Kumar, R; Kumar, D; Sharma, SK; Kumar, M. The CAS is 99-04-7. Through research, I have a further understanding and discovery of 3-Methylbenzoic acid

A gas sensor has been fabricated by depositing the thin film of Functionalized Graphene Oxide (GO) using Langmuir Blodget (LB) technique on SiO2/Si wafers. Aluminum (Al) contacts were deposited using thermal evaporation technique for measuring the resistance of fabricated thin film. Three different concentrations (15 mM, 50 mM, 75 mM) of Meta Toluic acid (MTA) have been used for functionalization of GO. X-Ray Diffraction (XRD), Fourier-transform infrared spectroscopy (FTIR) and Raman spectroscopy were used to characterize the Graphene Oxide (GO) after functionalization. Also, Scanning Electron Microscopy (SEM) was carried out for both GO and functionalized GO to study the surface morphology. Gas sensing behavior of functionalized GO has been investigated using two probe resistance measurement method for different concentration of ammonia gas. Sensor response was studied for ammonia concentration varied from 100 to 2000 ppm. Highest response obtained at 100 ppm concentration was found to be similar to 12.2% for sample TG(75). Higher concentration of MTA (up to a critical value) in GO leads to higher response of ammonia gas. This enhanced gas response has been due to the increased ester formation reaction at the surface of sensing film, which eventually leads to more interaction with NH3 gas molecules. In addition, defects and carbon vacancy in functionalized GO also acts as the trapping sites for gas molecules being sensed. The selectivity of the sensor has been investigated in different environment and sensor was found to be very selective towards ammonia gas. For stability investigation of the fabricated sensor, the sensor response has been recorded for 45 days.

About 3-Methylbenzoic acid, If you have any questions, you can contact Kumar, R; Kumar, A; Singh, R; Kashyap, R; Kumar, R; Kumar, D; Sharma, SK; Kumar, M or concate me.. SDS of cas: 99-04-7

Reference:
Isothiazole – Wikipedia,
,Isothiazole – ScienceDirect.com

Recently I am researching about GELS; ORGANOGELS; PROPERTY; DESIGN, Saw an article supported by the DST-PURSE program. Published in ACADEMIC PRESS INC ELSEVIER SCIENCE in SAN DIEGO ,Authors: Yadav, P; Ballabh, A. The CAS is 99-04-7. Through research, I have a further understanding and discovery of 3-Methylbenzoic acid. HPLC of Formula: C8H8O2

A new series of N-(thiazol-2-yl) benzamide derivatives were synthesized, characterized and investigated for their gelation behavior with the aim to elucidate the role of methyl functionality and multiple non-covalent interactions on gelation/non-gelation behavior using Crystal engineering approach. Interestingly, two amides, namely, 3-methyl-N-(thiazol-2-yl) benzamide (1c) and 3-methyl-N-(5-methylthiazol-2-yl) benzamide (3c) displayed gelation behavior towards ethanol/water and methanol/water mixture with good stability and low minimum gelator concentration (MGC). The single crystal structure of gelator (1c) displayed the helical assembly driven by pi-pi interaction along with cyclic N-H center dot center dot center dot N and S center dot center dot center dot O interaction, whereas single crystal structure of gelator (3c) displayed 2D hydrogen bonded network without any pi-pi interaction.

About 3-Methylbenzoic acid, If you have any questions, you can contact Yadav, P; Ballabh, A or concate me.. HPLC of Formula: C8H8O2

Reference:
Isothiazole – Wikipedia,
,Isothiazole – ScienceDirect.com

Name: 3-Methylbenzoic acid. Authors Kansiz, S; Qadir, AM; Dege, N; Faizi, SH in ELSEVIER published article about in [Kansiz, Sevgi] Samsun Univ, Dept Fundamental Sci, Fac Engn, TR-55420 Samsun, Turkey; [Qadir, Adnan M.] Salahaddin Univ, Coll Sci, Dept Chem, Erbil 44001, Iraq; [Dege, Necmi] Ondokuz Mayis Univ, Fac Arts & Sci, Dept Phys, TR-55139 Samsun, Turkey; [Faizi, Serajul Haque] BRA Bihar Univ, Langat Singh Coll, PG Dept Chem, Muzaffarpur 842001, Bihar, India in 2021, Cited 42. The Name is 3-Methylbenzoic acid. Through research, I have a further understanding and discovery of 99-04-7

In this study, two new copper (II) carboxylate complexes, [Cu(4-mba)(2) (tmeda)](1) and [Cu(3mba)(2)(H2O)(2)(tmeda)](2) (4-mbaH = 4-methylbenzoic acid, 3-mbaH = 3-methylbenzoic acid, tmeda = N,N,N’,N’-tetramethylethyleneamine) were synthesized. The structures and properties of the complexes were determined by X-ray single crystal diffraction method and FT-IR spectroscopy. While the crystal packing of the complex 1 is stabilized by C-H center dot center dot center dot O hydrogen bonds, in the complex 2, the molecules are connected to each other by C-H center dot center dot center dot O and O-H center dot center dot center dot O hydrogen bonds. The optimized structures were formed using density functional theory (DFT) at the B3LYP level within the 6-311G(d,p) and LAN2DZ basis sets. Their Hirshfeld surface analyses were performed for the detailed investigation of all the contacts involved in the crystal packing. 2D fingerprint plots and Hirshfeld surface analyses signify important interactions in the crystal packing [H center dot center dot center dot H (64.2%), C center dot center dot center dot H/H center dot center dot center dot C (21.1%) and O center dot center dot center dot H/H center dot center dot center dot O (14.7%) contacts for [Cu(4-mba) 2(tmeda)], while [Cu(3-mba)(2)(H2O)(2)(tmeda)] showed H center dot center dot center dot H (67.3%), C center dot center dot center dot H/H center dot center dot center dot C (21.8%) and O center dot center dot center dot H/H center dot center dot center dot O (10.9%) contacts]. (C) 2021 Elsevier B.V. All rights reserved.

Name: 3-Methylbenzoic acid. About 3-Methylbenzoic acid, If you have any questions, you can contact Kansiz, S; Qadir, AM; Dege, N; Faizi, SH or concate me.

Reference:
Isothiazole – Wikipedia,
,Isothiazole – ScienceDirect.com