Pyruvic acid, (4-hydroxy-3-methoxyphenyl)-2-thio-
3-(4-hydroxy-3-methoxyphenyl)-2-sulfanylidenepropanoic acid
Also Known As: Pyruvic acid, (4-hydroxy-3-methoxyphenyl)-2-thio-|4-Pyrrol-1-yl-benzolsulfonsaeure-amid|3-(4-hydroxy-3-methoxyphenyl)-2-sulfanylidenepropanoic acid|3-(4-Hydroxy-3-methoxyphenyl)-2-thioxopropanoic acid|Benzenepropanoic acid, 4-hydroxy-3-methoxy-.alpha.-thioxo-|2-Thioxo-3-(4-hydroxy-3-methoxyphenyl)propanoic acid|3-(4-Hydroxy-3-methoxyphenyl)-2-thioxopropionic acid|3-(4-hydroxy-3-methoxy-phenyl)-2-thioxo-propanoic acid|3-(4-Hydroxy-3-methoxyphenyl)-2-thioxopropanoic acid #
| Molecular Formula | C10H10O4S |
|---|---|
| Molecular Weight | 226.02998 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 98.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 226.02998 |
| Monoisotopic Mass | 226.02998 |
| Heavy Atoms | 15 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 6299-61-2 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)CC(=S)C(=O)O)O |
| InChIKey | LYRYUVTXTTUSSY-UHFFFAOYSA-N |
Product Overview
Pyruvic acid, (4-hydroxy-3-methoxyphenyl)-2-thio- (CAS 6299-61-2), with molecular formula C10H10O4S and molecular weight 226.02998 g/mol. IUPAC: 3-(4-hydroxy-3-methoxyphenyl)-2-sulfanylidenepropanoic acid.