| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 32VRU6KY3C |
| EPA CompTox | DTXSID40198990 |
| InChI Key | QPDXBKHZJRUURK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H13Cl1O1 |
| Molecular Weight | 184.07 |
| AlogP | 3.48 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 12.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 50992-44-4 |
| NORMAN SUSDAT | |
| FDA SRS | 32VRU6KY3C |
| PubChem | 3016583 |
| ChemSpider | 2284510.0 |