120781-02-4

Basic information

• Product Name: 2-BROMO-3-METHYL-3H-IMIDAZOLE-4-CARBOXYLIC ACID METHYL ESTER
• Synonyms: Methyl 2-bromo-1-methyl-1H-imidazole-5-carboxylate;2-Bromo-5-(methoxycarbonyl)-1-methyl-1H-imidazole;1H-Imidazole-5-carboxylicacid, 2-bromo-1-methyl-, methyl ester;2-BROMO-3-METHYL-3H-IMIDAZOLE-4-CARBOXYLIC ACID METHYL ESTER
• CAS NO: 120781-02-4
• Molecular Formula: C₆H₇BrN₂O₂
• Molecular Weight: 219.04
• Mol File: 120781-02-4.mol

Chemical Properties

• Boiling Point: 316.5°Cat760mmHg
• Flash Point: 145.2°C
• Appearance: /
• Density: 1.67g/cm³
• Vapor Pressure: 0.000408mmHg at 25°C
• Refractive Index: 1.589
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• PKA: 1.04±0.25(Predicted)
• CAS DataBase Reference: 2-BROMO-3-METHYL-3H-IMIDAZOLE-4-CARBOXYLIC ACID METHYL ESTER(CAS DataBase Reference)
• NIST Chemistry Reference: 2-BROMO-3-METHYL-3H-IMIDAZOLE-4-CARBOXYLIC ACID METHYL ESTER(120781-02-4)
• EPA Substance Registry System: 2-BROMO-3-METHYL-3H-IMIDAZOLE-4-CARBOXYLIC ACID METHYL ESTER(120781-02-4)

Safety Data

• Hazardous Substances Data: 120781-02-4(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
2-BROMO-3-METHYL-3H-IMIDAZOLE-4-CARBOXYLIC ACID METHYL ESTER is used as a key intermediate in the synthesis of anti-tuberculosis drug PA-824 against M. tuberculosis. It plays a crucial role in the development of this medication, which is designed to target and eliminate the tuberculosis bacteria effectively.
In the synthesis process, 2-BROMO-3-METHYL-3H-IMIDAZOLE-4-CARBOXYLIC ACID METHYL ESTER contributes to the formation of the final drug molecule, which possesses the necessary pharmacological properties to combat tuberculosis. Its unique structure and reactivity make it a valuable component in the creation of PA-824, a drug that holds promise for the treatment of drug-resistant tuberculosis strains and improving patient outcomes.

InChI:InChI=1/C6H7BrN2O2/c1-9-4(5(10)11-2)3-8-6(9)7/h3H,1-2H3

Upstream product

• 17289-20-2 methyl 1-methyl-1H-imidazole-5-carboxylate 
• 41806-40-0 1-methyl-1H-imidazole-5-carboxylic acid 
• 19485-38-2 1-methyl-1H-imidazole-4,5-dicarboxylic acid 
• 19485-35-9 1-methyl-4,5-dicyanoimidazole 

Downstream Products

• 852180-96-2 1-methyl-2-bromoimidazole-5-carboxylic acid 
• 1104736-12-0 2-(4-benzoimidazol-1-ylmethyl-phenyl)-3-methyl-3H-imidazole-4-carboxylic acid methyl ester 
• 1104736-30-2 2-(4-benzoimidazol-1-yl-phenyl)-3-methyl-3H-imidazole-4-carboxylic acid methyl ester 
• 1202942-04-8 methyl 2-(4-fluorophenyl)-1-methyl-1H-imidazole-5-carboxylate 
• 1202942-02-6 methyl 1-methyl-2-[4-(trifluoromethyl)phenyl]-1H-imidazole-5-carboxylate 
• 1202942-03-7 methyl 2-(4-cyanophenyl)-1-methyl-1H-imidazole-5-carboxylate 
• 1202942-06-0 methyl 2-(3-fluoro-4-methoxyphenyl)-1-methyl-1H-imidazole-5-carboxylate 
• 1202942-05-9 methyl 1-methyl-2-[4-(trifluoromethoxy)phenyl]-1H-imidazole-5-carboxylate 
• 746671-40-9 methyl 1-methyl-2-phenyl-1H-imidazole-5-carboxylate 
• 1373150-44-7 3-methyl-2-[4-(trifluoromethyl)phenyl]-3H-imidazole-4-carboxylic acid 

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