1H-Imidazole-4-carboxylic acid, 2,3-dihydro-3-methyl-2-thioxo-, methyl ester
methyl 3-methyl-2-sulfanylidene-1H-imidazole-4-carboxylate
Also Known As: Methyl 2-mercapto-1-methyl-1H-imidazole-5-carboxylate|Methyl 1-methyl-2-sulfanyl-1H-imidazole-5-carboxylate|Maybridge4_002452|ACMC-1BGT2|EINECS 272-595-7|KS-00000GJZ|BUTTPARK 52\04-76|KM1228|AC-9345|AN-7109|METHYL 1-METHYL-2-MERCAPTO-1H-IMIDAZOLE-5-CARBOXYLATE|2-Mercapto-1-methylimidazole-5-carboxylic acid methyl ester|methyl 3-methyl-2-sulfanylidene-1H-imidazole-4-carboxylate|4H-021|1H-Imidazole-4-carboxylic acid, 2,3-dihydro-3-methyl-2-thioxo-, methyl ester
| Molecular Formula | C6H8N2O2S |
|---|---|
| Molecular Weight | 172.03065 g/mol |
| LogP | 0.86929 |
| Topological Polar Surface Area | 47.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 172.03065 |
| Monoisotopic Mass | 172.03065 |
| Heavy Atoms | 11 |
| Complexity | 325.56842 |
Chemical Identifiers
| CAS Number | 68892-07-9 |
|---|---|
| SMILES | CN1C(=CNC1=S)C(=O)OC |
Product Overview
1H-Imidazole-4-carboxylic acid, 2,3-dihydro-3-methyl-2-thioxo-, methyl ester (CAS 68892-07-9), with molecular formula C6H8N2O2S and molecular weight 172.03065 g/mol. IUPAC: methyl 3-methyl-2-sulfanylidene-1H-imidazole-4-carboxylate.