| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | BSP7WNI0XX |
| EPA CompTox | DTXSID3023974 |
| InChI Key | LMCOQDVJBWVNNI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H7Cl1O2S1 |
| Molecular Weight | 189.99 |
| AlogP | 1.74 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 34.14 |
| Heavy Atoms | 11.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 98-57-7 |
| NORMAN SUSDAT | |
| FDA SRS | BSP7WNI0XX |
| PubChem | 7395 |
| ChemSpider | 3005.0 |