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CAS Number: 64038-64-8
ethyl 2-mercapto-1H-imidazole-4-carboxylate

Structure

 ethyl 2-mercapto-1H-imidazole-4-carboxylate
Name: ethyl 2-mercapto-1H-imidazole-4-carboxylate
Synonyms:
General Information
Product Number: 64038648

CAS Registry Number 64038-64-8
Name:
1H-?Imidazole-?4-?carboxylic acid, 2,?3-?dihydro-?2-?thioxo-?, ethyl ester
Imidazole-4(or 5)-carboxylic acid, 2-mercapto-, ethyl ester (6CI)
2-Mercapto-1H-imidazole-4-carboxylic acid ethyl ester
4-Ethoxycarbonyl-2-mercaptoimidazole
Ethyl 2-mercapto-1H-imidazole-4-carboxylate
Ethyl 2-mercaptoimidazole-4-carboxylate

 

Chemical Formula: C6H8N2O2S
Exact Mass: 172.03
Molecular Weight: 172.20
m/z: 172.03 (100.0%), 173.03 (8.1%), 174.03 (5.0%)

 

InChI:InChI=1S/C6H8N2O2S/c1-2-10-5(9)4-3-7-6(11)8-4/h3H,2H2,1H3,(H2,7,8,11)

InChI Key:PONOGPICUOALRU-UHFFFAOYSA-N

Canonical SMILES:CCOC(=O)C1=CNC(=S)N1

 

Thermal Properties Value Condition Note
Melting Point 184 °C   (1)CAS

Specification

98%
References
  1. (1) Jones, Reuben G.; US 2541924 1951 CAPLUS
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