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3,5-diMethyl-2-nitrobenzoic acid is a chemical compound with the formula C9H9NO4, belonging to the benzoic acid derivatives. It features a nitro group and two methyl groups, making it a versatile intermediate in organic synthesis and a valuable reagent in various applications.

52095-18-8

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52095-18-8 Usage

Uses

Used in Pharmaceutical Industry:
3,5-diMethyl-2-nitrobenzoic acid is used as a raw material for the synthesis of pharmaceuticals, contributing to the development of new drugs and medicines.
Used in Dye Industry:
It serves as a precursor in the production of dyes, playing a crucial role in the creation of colorants for various applications.
Used in Organic Chemistry Research:
3,5-diMethyl-2-nitrobenzoic acid is utilized as a reagent in the field of organic chemistry, aiding in the advancement of chemical knowledge and the discovery of new compounds.
Used in Enzyme Kinetics Studies:
3,5-diMethyl-2-nitrobenzoic acid is employed in the study of enzyme kinetics, helping researchers understand the mechanisms and dynamics of enzymatic reactions.

Check Digit Verification of cas no

The CAS Registry Mumber 52095-18-8 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 5,2,0,9 and 5 respectively; the second part has 2 digits, 1 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 52095-18:
(7*5)+(6*2)+(5*0)+(4*9)+(3*5)+(2*1)+(1*8)=108
108 % 10 = 8
So 52095-18-8 is a valid CAS Registry Number.

52095-18-8SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 3,5-Dimethyl-2-nitrobenzoic acid

1.2 Other means of identification

Product number -
Other names -

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:52095-18-8 SDS

52095-18-8Relevant academic research and scientific papers

Pendant Alkoxy Groups on N-Aryl Substitutions Drive the Efficiency of Imidazolylidene Catalysts for Homoenolate Annulation from Enal and Aldehyde

Kyan, Ryuji,Mase, Nobuyuki,Narumi, Tetsuo,Sato, Kohei

supporting information, p. 19031 - 19036 (2020/08/25)

Hydrogen-transfer in the tetrahedral intermediate generated from an imidazolylidene catalyst and α,β-unsaturated aldehyde forms a conjugated Breslow intermediate. This is a critical step affecting the efficiency of the NHC-catalyzed γ-butyrolactone formation via homoenolate addition to aryl aldehydes. A novel type of imidazolylidene catalyst with pendant alkoxy groups on the ortho-N-aryl groups is described. Catalyst of this sort facilitates the formation of the conjugated Breslow intermediate. Studies of the rate constants for homoenolate annulation affording γ-butyrolactones, reveal that introduction of the oxygen atoms in the appropriate position of the N-aryl substituents can increase the efficiency of imidazolylidene catalysts. Structural and mechanistic studies revealed that pendant alkoxy groups can be located close to the proton of the tetrahedral intermediate, thereby facilitating the proton transfer.

Divergent Syntheses of Indoles and Quinolines Involving N1-C2-C3 Bond Formation through Two Distinct Pd Catalyses

San Jang, Su,Kim, Young Ho,Youn, So Won

supporting information, p. 9151 - 9157 (2020/11/03)

Pd-catalyzed annulative couplings of 2-alkenylanilines with aldehydes using alcohols as both the solvent and hydrogen source have been developed. These domino processes allow divergent syntheses of two significant N-heterocycles, indoles and quinolines, from the same substrate by tuning reaction parameters, which seems to invoke two distinct mechanisms. The nature of the ligand and alcoholic solvent had a profound influence on the selectivity and efficiency of these protocols. Particularly noteworthy is that indole formation was achieved by overcoming two significant challenges, regioselective hydropalladation of alkenes and subsequent reactions between the resulting Csp3-Pd species and less reactive imines.

Method for synthetizing 2-amino-1, 3, 5-benzenetricarboxylic acid and application thereof for preparation of NH2-MOF-808

-

Paragraph 0022; 0034-0036; 0042-0044; 0049-0051; 0056-0058, (2019/06/27)

The invention belongs to the field of preparation and application of organic compounds and metal-organic framework compounds, and discloses a method for synthetizing 2-amino-1, 3, 5-benzenetricarboxylic acid and an application thereof for preparation of a

Twist does a twist to the reactivity: Stoichiometric and catalytic oxidations with twisted tetramethyl-IBX

Moorthy, Jarugu Narasimha,Senapati, Kalyan,Parida, Keshaba Nanda,Jhulki, Samik,Sooraj, Kunnikuruvan,Nair, Nisanth N.

experimental part, p. 9593 - 9601 (2012/01/03)

The methyl groups in TetMe-IBX lower the activation energy corresponding to the rate-determining hypervalent twisting (theoretical calculations), and the steric relay between successive methyl groups twists the structure, which manifests in significant solubility in common organic solvents. Consequently, oxidations of alcohols and sulfides occur at room temperature in common organic solvents. In situ generation of the reactive TetMe-IBX from its precursor iodo-acid, i.e., 3,4,5,6-tetramethyl-2-iodobenzoic acid, in the presence of oxone as a co-oxidant facilitates the oxidation of diverse alcohols at room temperature.

Discovery, Modeling, and Human Pharmacokinetics of N-(2-Acetyl-4,6-dimethylphenyl)-3-(3,4-dimethylisoxazol-5-ylsulfamoyl) -thiophene-2-carboxamide (TBC3711), a Second Generation, ETA Selective, and Orally Bioavailable Endothelin Antagonist

Wu, Chengde,Decker, E. Radford,Blok, Natalie,Bui, Huong,You, Tony J.,Wang, Junmei,Bourgoyne, Andree R.,Knowles, Vippra,Berens, Kurt L.,Holland, George W.,Brock, Tommy A.,Dixon, Richard A. F.

, p. 1969 - 1986 (2007/10/03)

Sitaxsentan (1) (Wu et al. J. Med. Chem. 1997, 40, 1690) is our first endothelin antagonist being evaluated in clinical trials. It has demonstrated biological effects in an acute hemodynamic study in CHF (Givertz et al. Circulation 2000, 101, 2922), an op

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