| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 4K9R3634UY |
| EPA CompTox | DTXSID5068520 |
| InChI Key | FBBRKYLXMNQFQU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H15Cl1O1 |
| Molecular Weight | 210.08 |
| AlogP | 3.8 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 49763-65-7 |
| NORMAN SUSDAT | |
| FDA SRS | 4K9R3634UY |
| PubChem | 170812 |
| ChemSpider | 149338.0 |