99585-13-4

Basic information

• Product Name: 5-CHLORO-2-METHYL-BENZOIC ACID METHYL ESTER
• Synonyms: 5-CHLORO-2-METHYL-BENZOIC ACID METHYL ESTER;Methyl 5-Chloro-2-Methylbenzoate;methyl 2-methyl-5-chlorobenzoate
• CAS NO: 99585-13-4
• Molecular Formula: C₉H₉ClO₂
• Molecular Weight: 184.62
• Mol File: 99585-13-4.mol
• Article Data: 10

Chemical Properties

• Boiling Point: 245.6±20.0 °C(Predicted)
• Appearance: /
• Density: 1.186±0.06 g/cm3(Predicted)
• Storage Temp.: Sealed in dry,Room Temperature
• CAS DataBase Reference: 5-CHLORO-2-METHYL-BENZOIC ACID METHYL ESTER(CAS DataBase Reference)
• NIST Chemistry Reference: 5-CHLORO-2-METHYL-BENZOIC ACID METHYL ESTER(99585-13-4)
• EPA Substance Registry System: 5-CHLORO-2-METHYL-BENZOIC ACID METHYL ESTER(99585-13-4)

Safety Data

• Hazardous Substances Data: 99585-13-4(Hazardous Substances Data)

Usage

General Description

5-CHLORO-2-METHYL-BENZOIC ACID METHYL ESTER is a compound with the chemical formula C9H9ClO2. It is a methyl ester of 5-chloro-2-methylbenzoic acid, which is a derivative of benzoic acid. This chemical is commonly used as an intermediate in the synthesis of pharmaceuticals and agrochemicals. It is a white to off-white crystalline solid with a melting point of 124-127°C. Its main applications include its use as a building block in the synthesis of various pharmaceutical and agrochemical compounds. Additionally, it is also used as a key component in the manufacturing of fragrances and flavorings.

Upstream product

• 67-56-1 methanol 
• 7499-06-1 5-chloro-2-methylbenzoic acid 
• 118-90-1 ortho-methylbenzoic acid 
• 74-88-4 methyl iodide 
• 2905-69-3 methyl 2,5-dichlorobenzoate 
• 75-16-1 methylmagnesium bromide 
• 201230-82-2 carbon monoxide 
• 95-73-8 2,4-dichlorotoluene 

Downstream Products

• 668262-52-0 methyl 2-(bromomethyl)-5-chlorobenzoate 
• 76254-23-4 5-Chloro-2-cyanomethyl-benzoic acid methyl ester 
• 37156-28-8 2-Bromomethyl-5-chlorobenzoesaeure 
• 1403679-89-9 2-(5-chloro-2-methyl-phenyl)-1H-pyrrole-3-carbonitrile 
• 1040721-01-4 N-[5-(5-chloro-2-methylphenyl)-2H-pyrazol-3-yl]-4-piperidin-1-ylbutyramide formate salt 
• 1608129-75-4 5-amino-3-(5-chloro-2-methylphenyl)pyrazole-1-carboxylic acid tert-butyl ester 
• 1608129-79-8 C₁₉H₂₂ClN₃O₄ 
• 1040724-39-7 5-(5-chloro-2-methylphenyl)-2H-pyrazol-3-ylamine 
• 1040720-89-5 N-[5-(5-chloro-2-methylphenyl)-2H-pyrazol-3-yl]-4-pyrrolidin-1-yl-butyramide formate salt 
• 1403679-77-5 2-(5-chloro-2-methyl-phenyl)-5-(pyrimidin-4-yl)-1H-pyrrole-3-carboxamide 
• 1403680-20-5 5-acetyl-2-(5-chloro-2-methyl-phenyl)-1H-pyrrole-3-carbonitrile 
• 1403680-22-7 2-(5-chloro-2-methyl-phenyl)-5-(pyrimidin-4-yl)-1H-pyrrole-3-carbonitrile 
• 1403679-76-4 2-(5-chloro-2-methyl-phenyl)-5-(2-methylamino-pyrimidin-4-yl)-1H-pyrrole-3-carboxamide 
• 1403680-21-6 2-(5-chloro-2-methyl-phenyl)-5-(2-methylamino-pyrimidin-4-yl)-1H-pyrrole-3-carbonitrile 

Relevant articles and documents

INHIBITORS OF INFLUENZA VIRUS REPLICATION

Methods of inhibiting the replication of influenza viruses in a biological sample or patient, of reducing the amount of influenza viruses in a biological sample or patient, and of treating influenza in a patient, comprises administering to said biological

Design and synthesis of a hybrid series of potent and selective agonists of α7 nicotinic acetylcholine receptor

α7 nicotinic acetylcholine receptor agonists are promising therapeutic candidates for the treatment of cognitive impairment. As a follow up of our internal medicinal chemistry program we investigated a novel series of α7 nAChR agonists. Starting from molecular docking studies on two series of molecules recently developed in our laboratories, an alternative scaffold was designed attempting to combine the optimal features of these previously identified urea and pyrazole compounds. Based on our previous SAR knowledge and on predicted drug-like properties, a small library was synthesized in parallel manner, affording compounds with excellent α7 nAChR activity, selectivity and preliminary ADME profile.

Chemoselective sp 2-sp3 cross-couplings: Iron-catalyzed alkyl transfer to dihaloaromatics

The chemoselective functionalization of a range of dihaloaromatics with methyl, cyclopropyl, and higher alkyl Grignard reagents via iron-catalyzed cross-coupling is described. The site selectivity of C-X (X = halogen) activation is determined by factors such as the position of the halogen on the ring, the solvent, and the nucleophile. A one-pot protocol for the chemoselective synthesis of mixed dialkyl heterocycles is achieved solely employing iron catalysis.