Category: 50-30-6

In 2020.0 MOLECULES published article about MOLECULAR-ORBITAL METHODS; CRYSTAL-STRUCTURES; CARBOXYLIC-ACIDS; GAS-PHASE; 2-FLUOROBENZOIC ACID; HIRSHFELD SURFACES; INFRARED-SPECTRA; ENERGY; PHOTOCHEMISTRY; DEGRADATION in [Ildiz, Gulce Ogruc; Fausto, Rui] Univ Coimbra, Dept Chem, CQC, P-3004535 Coimbra, Portugal; [Ildiz, Gulce Ogruc] Istanbul Kultur Univ, Fac Sci & Letters, Dept Phys, Atakoy Campus, TR-34156 Istanbul, Turkey in 2020.0, Cited 85.0. The Name is 2,6-Dichlorobenzoic acid. Through research, I have a further understanding and discovery of 50-30-6. COA of Formula: C7H4Cl2O2

This article presents a detailed comprehensive investigation of the ortho fluoro- and chloro- substituted benzoic acids both, as isolated molecules and in the crystalline phase. Quantum chemical calculations performed within the density functional theory (DFT) formalism are used to investigate the potential energy landscapes of the molecules, taking into special consideration the effects of the interactions between the carboxylic group and the ortho halogen substituents, as well as the nature of these later on the structure and properties of the investigated systems. The structures of the relevant conformers of the molecules are discussed in comparative terms, and used to rationalize experimental data obtained for the compounds in the gas phase and isolated in low-temperature inert matrices. The UV-induced photofragmentation reactions of two of the compounds isolated in cryogenic inert matrices were studied as illustrative cases. The structures of the crystals reported previously in the literature are revisited and discussed also in a comparative basis. Particular emphasis is given to the analysis of the intermolecular interactions in the different crystals, using Hirshfeld surface analysis, the CE-B3LYP energy decomposition model and the HOMA index, and to their correlation with thermodynamic data.

About 2,6-Dichlorobenzoic acid, If you have any questions, you can contact Ildiz, GO; Fausto, R or concate me.. COA of Formula: C7H4Cl2O2

Reference:
Chloride – Wikipedia,
,Chlorides – an overview | ScienceDirect Topics

An article Room temperature clickable coupling electron deficient amines with sterically hindered carboxylic acids for the construction of amides WOS:000597946100010 published article about CATIONIC-AMPHIPHILIC POLYMERS; PRIMARY ALCOHOLS; MEDICINAL CHEMISTS; DRUG DISCOVERY; BOND FORMATION; PEPTIDE; PHENOLS; REAGENTS; TRANSFORMATION; CONVERSION in [Liu, Jing; Qin, Hua-Li] Wuhan Univ Technol, Sch Chem Chem Engn & Life Sci, 205 Luoshi Rd, Wuhan 430070, Peoples R China; [Wang, Shi-Meng] Wuchang Univ Technol, Sch Life Sci, Wuhan 430223, Peoples R China in 2020.0, Cited 86.0. The Name is 2,6-Dichlorobenzoic acid. Through research, I have a further understanding and discovery of 50-30-6. COA of Formula: C7H4Cl2O2

A method for the synthesis of difficult-to-access amides was developed through the coupling of sterically hindered carboxylic acids and electron deficient amines via SO2F2-mediated dehydration. The method feathers with broad substrate scope, mild conditions, excellent functional group compatibility and high yields. (C) 2020 Elsevier Ltd. All rights reserved.

COA of Formula: C7H4Cl2O2. About 2,6-Dichlorobenzoic acid, If you have any questions, you can contact Liu, J; Wang, SM; Qin, HL or concate me.

Reference:
Chloride – Wikipedia,
,Chlorides – an overview | ScienceDirect Topics

HPLC of Formula: C7H4Cl2O2. I found the field of Chemistry very interesting. Saw the article Synthesis of Fe3O4 Nanoparticles and Their Application in Photo-Fenton Degradation of Direct Red 23 Dye in Aqueous Solutions published in 2019.0, Reprint Addresses Moradi, R (corresponding author), Islamic Azad Univ, Dept Chem, Tuyserkan Branch, Tuyserkan, Iran.. The CAS is 50-30-6. Through research, I have a further understanding and discovery of 2,6-Dichlorobenzoic acid.

In this paper, synthesized Fe3O4 nanoparticles applied as catalyst in photodegradation of Direct Red 23 (DR23) dye using photo-Fenton process in aqueous solution. The Fe3O4 nanoparticles were characterized by scanning electron microscopy (SEM), X-ray diffraction (XRD) and Fourier transform infrared spectroscopy (FT-IR). Design of experiments (DOE) based on Taguchi approach was used. Analysis the response of each experiment was based Signal to Noise (S/N) ratio was calculated. The effective parameters for the degradation of dye were determined and optimized using Taguchi (L-9 (3(4))) orthogonal array experimental design method with four factors having three levels for each factor. The Taguchi approach showed that pH 3 (level 1), catalyst amount = 25 mg/L (level 2), H2O2 concentration = 15 ppm (level 3), and temperature = 35 degrees C (level 3) was optimum conditions for this process. The factor most influencing the process was determined using analysis of variance (ANOVA) method. The most significant factor in this process was pH. The interaction between pH x catalyst amount was the most influencing interaction. The percent (p (%)) of each factor on the degradation of dye was found to be in the following the order: pH (50.306%), catalyst amount (6.887%), H2O2 concentration (39.272%), and temperature (3.456%). The percentage contribution of factors in this process was found to be in the following the order: pH (0.332), catalyst amount (0.101), H2O2 concentration (0.291), and temperature (0.082). So first order reaction with k = 0.0472 min(-1) was observed for the photocatalytic degradation reaction.

About 2,6-Dichlorobenzoic acid, If you have any questions, you can contact Moradi, R; Ganjali, A or concate me.. HPLC of Formula: C7H4Cl2O2

Reference:
Chloride – Wikipedia,
,Chlorides – an overview | ScienceDirect Topics

Quality Control of 2,6-Dichlorobenzoic acid. I found the field of Chemistry very interesting. Saw the article Phosphine-Catalyzed Chemoselective [4+3] Cycloaddition of Alminine Esters and beta ‘-acetoxy Allenoates for Divergent Synthesis of Azepines published in 2020.0, Reprint Addresses Zhou, QF (corresponding author), China Pharmaceut Univ, Dept Organ Chem, State Key Lab Nat Med, Nanjing 210009, Jiangsu, Peoples R China.. The CAS is 50-30-6. Through research, I have a further understanding and discovery of 2,6-Dichlorobenzoic acid.

Text. A general method for the synthesis of structural diversity and complexity of azepines from aldimine esters and beta ‘-acetoxy allenoates is reported. Under phosphine catalysis, a [4+3] cycloaddition for the formation of 1,3-dihydro-2H-azepine-2,2,4-tricarboxylates was achieved with broad substrate scope under mild reactions. A switchable process was given and a variety of important 2,3-dihydrochromeno[4,3-b]azepin-6(1H)-ones were selectively formed when the reaction was performed in the presence of Cs2CO3 and PPh3, which involved an intramolecular ester group migration and subsequent lactonization of 1,3-dihydro-2H-azepine-2,2,4-tricarboxylates. Besides easy handle process, high synthetic value of resulting products, it is worth to note that this work showed the novel example of 1,5-ethoxycarbonyl migration.

Quality Control of 2,6-Dichlorobenzoic acid. About 2,6-Dichlorobenzoic acid, If you have any questions, you can contact Dai, ZH; Zhu, J; Wang, JH; Su, WB; Yang, FL; Zhou, QF or concate me.

Reference:
Chloride – Wikipedia,
,Chlorides – an overview | ScienceDirect Topics

An article Oxidative C-H Acyloxylation of Acetone with Carboxylic Acids under Iodine Catalysis WOS:000607120600001 published article about METHYL KETONES; INTRAMOLECULAR CYCLIZATION; ELECTROPHILIC CYCLIZATION; MICHAEL ADDITION; ACCESS; STRATEGY; ANILINES; HYDROCHLORIDE; DERIVATIVES; INDOLES in [Zhou, Xiao-Yu; Chen, Xia] Liupanshui Normal Univ, Sch Chem & Mat Engn, Liupanshui 553004, Peoples R China in 2021.0, Cited 63.0. Safety of 2,6-Dichlorobenzoic acid. The Name is 2,6-Dichlorobenzoic acid. Through research, I have a further understanding and discovery of 50-30-6

Iodine-catalyzed oxidative C(sp(3))-H acyloxylation of acetone with carboxylic acids has been developed. The method employs iodide-as catalyst and sodium chlorite as oxidant. Substituted benzoic acids, naphthoic acids and heteroaromatic carboxylic acids can be used, and 2-oxopropyl carboxylates are obtained with good to excellent yields.

Safety of 2,6-Dichlorobenzoic acid. About 2,6-Dichlorobenzoic acid, If you have any questions, you can contact Zhou, XY; Chen, X or concate me.

Reference:
Chloride – Wikipedia,
,Chlorides – an overview | ScienceDirect Topics

An article Ligand-Based Design of Allosteric Retinoic Acid Receptor-Related Orphan Receptor gamma t (ROR gamma t) Inverse Agonists WOS:000507150400016 published article about NUCLEAR RECEPTOR; ACCURATE DOCKING; DIFFERENTIATION; MODULATORS; ALPHA; ANTAGONISTS; INTERFACE; DISCOVERY; PROGRAM; PHASE in [Meijer, Femke A.; Doveston, Richard G.; de Vries, Rens M. J. M.; Vos, Gael M.; Vos, Alex A. A.; Leysen, Seppe; Scheepstra, Marcel; Ottmann, Christian; Milroy, Lech-Gustav; Brunsveld, Luc] Tech Univ Eindhoven, Lab Chem Biol, Dept Biomed Engn, Dolech 2, NL-5612 AZ Eindhoven, Netherlands; [Meijer, Femke A.; Doveston, Richard G.; de Vries, Rens M. J. M.; Vos, Gael M.; Vos, Alex A. A.; Leysen, Seppe; Scheepstra, Marcel; Ottmann, Christian; Milroy, Lech-Gustav; Brunsveld, Luc] Tech Univ Eindhoven, Inst Complex Mol Syst, Dolech 2, NL-5612 AZ Eindhoven, Netherlands; [Doveston, Richard G.] Univ Leicester, Leicester Inst Struct & Chem Biol, Univ Rd, Leicester LE1 7RH, Leics, England; [Doveston, Richard G.] Univ Leicester, Dept Chem, Univ Rd, Leicester LE1 7RH, Leics, England in 2020.0, Cited 52.0. Name: 2,6-Dichlorobenzoic acid. The Name is 2,6-Dichlorobenzoic acid. Through research, I have a further understanding and discovery of 50-30-6

Retinoic acid receptor-related orphan receptor gamma t (ROR gamma t) is a nuclear receptor associated with the pathogenesis of autoimmune diseases. Allosteric inhibition of ROR gamma t is conceptually new, unique for this specific nuclear receptor, and offers advantages over traditional orthosteric inhibition. Here, we report a highly efficient in silico-guided approach that led to the discovery of novel allosteric ROR gamma t inverse agonists with a distinct isoxazole chemotype. The the most potent compound, 25 (FM26), displayed submicromolar inhibition in a coactivator recruitment assay and effectively reduced IL-17a mRNA production in EM cells, a marker of ROR gamma t activity. The projected allosteric mode of action of 25 was confirmed by biochemical experiments and cocrystallization with the ROR gamma t ligand binding domain. The isoxazole compounds have promising pharmacokinetic properties comparable to other allosteric ligands but with a more diverse chemotype. The efficient ligand-based design approach adopted demonstrates its versatility in generating chemical diversity for allosteric targeting of ROR gamma t.

Name: 2,6-Dichlorobenzoic acid. About 2,6-Dichlorobenzoic acid, If you have any questions, you can contact Meijer, FA; Doveston, RG; de Vries, RMJM; Vos, GM; Vos, AAA; Leysen, S; Scheepstra, M; Ottmann, C; Milroy, LG; Brunsveld, L or concate me.

Reference:
Chloride – Wikipedia,
,Chlorides – an overview | ScienceDirect Topics

I found the field of Environmental Sciences & Ecology very interesting. Saw the article Exploring QSAR models for assessment of acute fish toxicity of environmental transformation products of pesticides (ETPPs) published in 2020.0. HPLC of Formula: C7H4Cl2O2, Reprint Addresses Roy, K (corresponding author), Jadavpur Univ, Dept Pharmaceut Technol, Drug Theoret & Cheminformat Lab, Kolkata 700032, India.. The CAS is 50-30-6. Through research, I have a further understanding and discovery of 2,6-Dichlorobenzoic acid

Environmental transformation products of pesticides (ETPPs) have a great deal of ecological impact owing to their ability to cause toxicity to the aquatic organisms, which can then be translated to the humans. The limited experimental data on biochemical and toxic effects of ETPPs, the high test costs together with regulatory limitations and the international push to reduce animal testing encourage greater dependence on predictive in silico techniques like quantitative structure-activity relationship (QSAR) models. The aim of the present work was to explore the key structural features, which regulate the toxicity towards fishes, for 85 ETPPs using a partial least squares (PLS) regression based chemometric model developed according to Organisation for Economic Co-operation and Development (OECD) guidelines. The model was extensively validated using both internal and external validation metrics, and the results so obtained justify the reliability and usefulness of the developed model (Q(2) = 0.648, R-pred(2) or Q(F1)(2) = 0.734 and Q(F2)(2) = 0.733). From the developed model, we can conclude that lipophilicity, polarity, presence of branching and the functional form of 0-atom in the transformed structures of pesticides are the important features that are to be considered during ecotoxicity assessment of ETPPs. The information obtained from the descriptors of the developed model could be utilized in the future for assessing ETPPs with the benefit of providing an early warning of their potentially detrimental effect on fishes for regulatory purposes. (C) 2020 Elsevier Ltd. All rights reserved.

HPLC of Formula: C7H4Cl2O2. About 2,6-Dichlorobenzoic acid, If you have any questions, you can contact Pandey, SK; Ojha, PK; Roy, K or concate me.

Reference:
Chloride – Wikipedia,
,Chlorides – an overview | ScienceDirect Topics

An article Cobalt (II) Phthalocyanine Sulfonate Supported on Reduced Graphene Oxide (RGO) as a Recyclable Photocatalyst for the Oxidation of Aldehydes to Carboxylic Acids WOS:000545059000002 published article about SINGLET OXYGEN; TITANIUM-DIOXIDE; KINETICS; PHOTOOXYGENATION; MECHANISMS; 4,4,4,4-TETRASULFOPHTHALOCYANINE; TETRASULFOPHTHALOCYANINE; AUTOXIDATION; DERIVATIVES; GENERATION in [Hajimohammadi, Mahdi; Tuna, Ali; Knoer, Guenther] Johannes Kepler Univ Linz, Inst Inorgan Chem, Altenberger Str 69, A-4040 Linz, Austria; [Hajimohammadi, Mahdi; Azizi, Naeleh] Kharazmi Univ, Fac Chem, GC POB 14911-15719, Tehran, Iran; [Tollabimazraeno, Sajjad] CEO Instrument Futurism, Paul Hahn Str 1-3, A-4020 Linz, Austria; [Duchoslav, Jiri] Oberflachentechnol GmbH, CEST Kompetenzzentrum Elektrochem, Viktor Kaplan Str 2, A-2700 Wiener Neustadt, Austria in 2021.0, Cited 52.0. Category: chlorides-buliding-blocks. The Name is 2,6-Dichlorobenzoic acid. Through research, I have a further understanding and discovery of 50-30-6

The development of robust and cheap photocatalyst systems for visible-light induced organic substrate transformations is a significant uprising research topic at the crossroads of green chemistry and modern synthetic methodology. Atom economy, efficiency and selectivity are key parameters for the future practical applicability of the specific processes catalyzed. In this context, we report a simple and sustainable oxygen-dependent route for oxidizing various aromatic and aliphatic aldehydes to the corresponding carboxylic acids at room temperature under visible light and sunlight irradiation mediated by cobalt phthalocyanine tetrasulfonic acid (CoPcS) supported on reduced graphene oxide (RGO). Remarkably, products are obtained with (81-100)% conversion and 100% selectivity. [GRAPHICS] .

Category: chlorides-buliding-blocks. About 2,6-Dichlorobenzoic acid, If you have any questions, you can contact Hajimohammadi, M; Azizi, N; Tollabimazraeno, S; Tuna, A; Duchoslav, J; Knor, G or concate me.

Reference:
Chloride – Wikipedia,
,Chlorides – an overview | ScienceDirect Topics

Friedman, AS; Horn, SJL in [Friedman, Abigail S.] Yale Sch Publ Hlth, Dept Hlth Policy & Management, 60 Coll St,Rm 303, New Haven, CT 06520 USA; [Horn, Samantha J. L.] Northwestern Univ, Global Poverty Res Lab, Evanston, IL USA published Socioeconomic Disparities in Electronic Cigarette Use and Transitions from Smoking in 2019.0, Cited 38.0. Application In Synthesis of 2,6-Dichlorobenzoic acid. The Name is 2,6-Dichlorobenzoic acid. Through research, I have a further understanding and discovery of 50-30-6.

Introduction Socioeconomic disparities have been established for conventional cigarette use, but not for electronic cigarettes. This study estimates socioeconomic gradients in exclusive use of conventional cigarettes, electronic cigarettes, and dual use (ie, use of both products) among adults in the United States. Methods Analyses consider nationally representative data on 25- to 54-year-old respondents to the 2014-2016 National Health Interview Surveys (N = 50306). Demographically adjusted seemingly unrelated regression models estimate how two socioeconomic status measures-respondent education and household income-relate to current exclusive use of conventional cigarettes, electronic cigarettes, and dual use. Results Conventional cigarette use exhibits negative education and income gradients, consistent with existing research: -12.9 percentage points (confidence interval [CI]: -14.0, -11.8) if college educated, and -9.5 percentage points (CI: -10.9, -8.1) if household income exceeds 400% of the federal poverty level. These gradients are flatter for dual use (-1.4 [CI: -1.8, -0.9] and -1.9 [CI: -2.5, -1.2]), and statistically insignificant for electronic cigarette use (-0.03 [CI: -0.5, 0.4] and -0.3 [CI: -0.8, -0.2]). Limiting the sample to ever-smokers, higher education is associated with a 0.9 percentage point increase in likelihood of exclusive electronic cigarette use at interview (CI: 0.0, 1.9). Conclusions Education and income gradients in exclusive electronic cigarette use are small and statistically insignificant, contrasting with strong negative gradients in exclusive conventional cigarette use. Furthermore, more educated smokers are more likely to switch to exclusive e-cigarette use than less educated smokers. Such differential switching may exacerbate socioeconomic disparities in smoking-related morbidity and mortality, but lower the burden of tobacco-related disease. Implications Research has not yet established whether socioeconomic disparities in electronic cigarette (e-cigarette) use resemble those observed for conventional cigarettes. This article uses nationally representative data on US adults aged 25-54 to estimate income and education gradients in exclusive use of conventional cigarettes, e-cigarettes, and dual use. Both gradients are steep and negative for conventional cigarette use, but flat and statistically insignificant for e-cigarette use. Repeating the analysis among ever-smokers indicates that more educated smokers are more likely to transition toward exclusive e-cigarette use than less educated smokers. Such differential substitution may exacerbate disparities in smoking-related morbidity and mortality.

Application In Synthesis of 2,6-Dichlorobenzoic acid. About 2,6-Dichlorobenzoic acid, If you have any questions, you can contact Friedman, AS; Horn, SJL or concate me.

Reference:
Chloride – Wikipedia,
,Chlorides – an overview | ScienceDirect Topics

Computed Properties of C7H4Cl2O2. Raes, B; Horemans, B; Rentsch, D; T’Syen, J; Ghequire, MGK; De Mot, R; Wattiez, R; Kohler, HPE; Springael, D in [Raes, Bart; Horemans, Benjamin; T’Syen, Jeroen; Springael, Dirk] Katholieke Univ Leuven, Div Soil & Water Management, B-3000 Leuven, Belgium; [Ghequire, Maarten G. K.; De Mot, Rene] Katholieke Univ Leuven, Ctr Microbial & Plant Genet, B-3000 Leuven, Belgium; [Rentsch, Daniel] Swiss Fed Labs Mat Sci & Technol, Lab Funct Polymers, Empa, CH-8600 Dubendorf, Switzerland; [Wattiez, Ruddy] Univ Mons, Dept Prote & Microbiol, B-7000 Mons, Belgium; [Kohler, Hans-Peter E.] Swiss Fed Inst Aquat Sci & Technol, Dept Environm Microbiol, Eawag, CH-8600 Dubendorf, Switzerland published Aminobacter sp. MSH1 Mineralizes the Groundwater Micropollutant 2,6-Dichlorobenzamide through a Unique Chlorobenzoate Catabolic Pathway in 2019.0, Cited 52.0. The Name is 2,6-Dichlorobenzoic acid. Through research, I have a further understanding and discovery of 50-30-6.

2,6-Dichlorobenzamide (BAM) is a major groundwater micropollutant posing problems for drinking water treatment plants (DWTPs) that depend on groundwater intake. Aminobacter sp. MSH1 uses BAM as the sole source of carbon, nitrogen, and energy and is considered a prime biocatalyst for groundwater bioremediation in DWTPs. Its use in bioremediation requires knowledge of its BAM-catabolic pathway, which is currently restricted to the amidase BbdA converting BAM into 2,6-dichlorobenzoic acid (2,6-DCBA) and the monooxygenase BbdD transforming 2,6-DCBA into 2,6-dichloro-3-hydroxybenzoic acid. Here, we show that the 2,6-DCBA catabolic pathway is unique and differs substantially from catabolism of other chlorobenzoates. BbdD catalyzes a second hydroxylation, forming 2,6-dichloro-3,5-dihydroxybenzoic acid. Subsequently, glutathione-dependent dehalogenases (BbdI and BbdE) catalyze the thiolytic removal of the first chlorine. The remaining chlorine is then removed hydrolytically by a dehalogenase of the alpha/beta hydrolase superfamily (BbdC). BbdC is the first enzyme in that superfamily associated with dehalogenation of chlorinated aromatics and appears to represent a new subtype within the alpha/beta hydrolase dehalogenases. The activity of BbdC yields a unique trihydroxylated aromatic intermediate for ring cleavage that is performed by an extradiol dioxygenase (BbdF) producing 2,4,6-trioxoheptanedioic acid, which is likely converted to Krebs cycle intermediates by BbdG.

Computed Properties of C7H4Cl2O2. About 2,6-Dichlorobenzoic acid, If you have any questions, you can contact Raes, B; Horemans, B; Rentsch, D; T’Syen, J; Ghequire, MGK; De Mot, R; Wattiez, R; Kohler, HPE; Springael, D or concate me.

Reference:
Chloride – Wikipedia,
,Chlorides – an overview | ScienceDirect Topics