| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | KY9R9R74G9 |
| EPA CompTox | DTXSID3045061 |
| InChI Key | DDLBHIIDBLGOTE-UHFFFAOYNA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C3H7Cl1O4S1 |
| Molecular Weight | 173.98 |
| AlogP | -0.53 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 74.6 |
| Heavy Atoms | 9.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 107-57-3 |
| NORMAN SUSDAT | |
| FDA SRS | KY9R9R74G9 |
| ChemSpider | 29093.0 |