HuagongsheHuagongshe Chemistry Print Report · For research reference only
2-Oxo-3-sulfinopropanoic acid
b-Sulfinyl pyruvate · 2-oxo-3-sulfinopropanoic acid
Identifiers & Physical Properties
| CAS No. | 88947-38-0 |
|---|---|
| Molecular formula | C3H4O5S |
| Average molar mass | 152.13 g/mol |
| Monoisotopic mass | 151.9779444 g/mol |
| SMILES | O=C(O)C(=O)CS(=O)O |
| InChIKey | JXYLQEMXCAAMOL-UHFFFAOYSA-N |
| PubChem CID | 110 |
| ChEBI | CHEBI:1665 |
| DTXSID | DTXSID301308307 |
Chemical & Physical Properties
| XLogP | -1 |
|---|---|
| Topological polar surface area | 111 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 6 |
| Rotatable bonds | 3 |
| Heavy atoms | 9 |
| Formal charge | 0 |
| Complexity | 162 |
| Physical Description | Solid |