309279-57-0

Basic information

• Product Name: methyl 3-(1H-tetrazol-1-yl)benzoate
• Synonyms: SMR000114124;MLS000549485;Methyl 3-(1-Tetrazolyl)benzoate;methyl 3-(tetrazol-1-yl)benzoate;methyl 3-(1H-tetrazol-1-yl)benzoate;methyl 3-(1H-tetraazol-1-yl)benzoate;methyl 3-(1,2,3,4-tetrazol-1-yl)benzoate;3-(1-tetrazolyl)benzoic acid methyl ester;3-(tetrazol-1-yl)benzoic acid methyl ester;Benzoic acid, 3-(1H-tetrazol-1-yl)-, methyl ester
• CAS NO: 309279-57-0
• Molecular Formula: C9H8N4O2
• Molecular Weight: 204.19
• Mol File: 309279-57-0.mol
• Article Data: 0

Chemical Properties

• Boiling Point: 379.2±44.0 °C(Predicted)
• Appearance: /
• Density: 1.37±0.1 g/cm3(Predicted)
• PKA: 0.31±0.10(Predicted)
• CAS DataBase Reference: methyl 3-(1H-tetrazol-1-yl)benzoate(CAS DataBase Reference)
• NIST Chemistry Reference: methyl 3-(1H-tetrazol-1-yl)benzoate(309279-57-0)
• EPA Substance Registry System: methyl 3-(1H-tetrazol-1-yl)benzoate(309279-57-0)

Safety Data

• HazardClass: IRRITANT
• Hazardous Substances Data: 309279-57-0(Hazardous Substances Data)

Usage

Description

Methyl 3-(1H-tetrazol-1-yl)benzoate is a chemical compound that belongs to the class of esters. It is a derivative of benzoic acid that contains a tetrazole group. This versatile chemical is known for its potential applications in the pharmaceutical and chemical industries.

Uses

Used in Pharmaceutical Synthesis:
Methyl 3-(1H-tetrazol-1-yl)benzoate is used as a building block in the synthesis of pharmaceuticals, specifically for the production of angiotensin II receptor antagonists. These antagonists are crucial in the treatment of hypertension and other cardiovascular conditions, providing a valuable contribution to medical therapy.
Used in Metal Coordination Compounds:
In the field of coordination chemistry, methyl 3-(1H-tetrazol-1-yl)benzoate serves as a ligand for the development of metal coordination compounds. Its ability to chelate with metal ions allows for the creation of stable and functional complexes with potential applications in various areas, including catalysis and material science.
Used as a Precursor in Organic Chemistry:
Methyl 3-(1H-tetrazol-1-yl)benzoate also functions as a precursor for the preparation of various organic compounds. Its reactivity and structural features make it a useful intermediate in the synthesis of a range of chemical products, further expanding its utility in the chemical industry.