774608-89-8

Basic information

• Product Name: 5-BROMO-1H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID ETHYL ESTER
• Synonyms: 5-BROMO-1H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID ETHYL ESTER;Ethyl 5-bromo-1H-1,2,4-triazole-3-carboxylate;Ethyl 5-BroMo-1,2,4-triazole-3-carboxylate;ethyl 5-bromo-2H-1,2,4-triazole-3-carboxylate
• CAS NO: 774608-89-8
• Molecular Formula: C₅H₆BrN₃O₂
• Molecular Weight: 220.03
• Mol File: 774608-89-8.mol
• Article Data: 0

Chemical Properties

• Boiling Point: 354°C at 760 mmHg
• Flash Point: 167.9°C
• Appearance: /
• Density: 1.763g/cm³
• Vapor Pressure: 3.45E-05mmHg at 25°C
• Refractive Index: 1.57
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• PKA: 5.62±0.40(Predicted)
• CAS DataBase Reference: 5-BROMO-1H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID ETHYL ESTER(CAS DataBase Reference)
• NIST Chemistry Reference: 5-BROMO-1H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID ETHYL ESTER(774608-89-8)
• EPA Substance Registry System: 5-BROMO-1H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID ETHYL ESTER(774608-89-8)

Safety Data

• Hazardous Substances Data: 774608-89-8(Hazardous Substances Data)

Usage

Description

5-Bromo-1H-1,2,4-triazole-3-carboxylic acid ethyl ester is a versatile chemical compound belonging to the class of 1,2,4-triazole derivatives. It is an ester derivative of 5-bromo-1H-1,2,4-triazole-3-carboxylic acid, characterized by its unique structure and functional groups. 5-BROMO-1H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID ETHYL ESTER is widely recognized for its reactivity and serves as a valuable intermediate in the synthesis of pharmaceuticals, agrochemicals, and other organic compounds. Its applications extend to research laboratories, where it is utilized as a reagent for various organic synthesis reactions.

Uses

Used in Pharmaceutical Industry:
5-Bromo-1H-1,2,4-triazole-3-carboxylic acid ethyl ester is used as a key intermediate in the synthesis of new drugs and pharmaceutical compounds. Its unique structure and functional groups contribute to the development of innovative therapeutic agents with potential applications in various medical fields.
Used in Agrochemical Industry:
In the agrochemical sector, 5-Bromo-1H-1,2,4-triazole-3-carboxylic acid ethyl ester is employed as a building block in the production of agrochemicals. Its versatile reactivity allows for the creation of compounds with potential applications in crop protection, pest control, and other agricultural areas.
Used in Organic Synthesis:
5-Bromo-1H-1,2,4-triazole-3-carboxylic acid ethyl ester is used as a reagent in research laboratories for various organic synthesis reactions. Its unique properties make it a valuable component in the development of heterocyclic compounds and other complex organic molecules.
Used in Research and Development:
5-BROMO-1H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID ETHYL ESTER is utilized in research and development efforts to explore its potential applications and properties. Its unique structure and reactivity make it an interesting subject for scientific investigation, potentially leading to new discoveries and advancements in various fields.
Used in Chemical Production:
5-Bromo-1H-1,2,4-triazole-3-carboxylic acid ethyl ester is employed in the production of various chemical products, including intermediates for further synthesis and final products with specific applications. Its versatility and reactivity contribute to the development of a wide range of chemical compounds with diverse uses.

InChI:InChI=1/C5H6BrN3O2/c1-2-11-4(10)3-7-5(6)9-8-3/h2H2,1H3,(H,7,8,9)

Downstream Products

• 918445-28-0 ethyl 5-bromo-2-methyl-2H-1,2,4-triazole-3-carboxylate 
• 918445-29-1 ethyl 5-bromo-1-methyl-1H-1,2,4-triazole-3-carboxylate 
• 918445-27-9 ethyl 5-bromo-4-methyl-4H-1,2,4-triazole-3-carboxylate