| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 3DJX63N6JH |
| EPA CompTox | DTXSID00195288 |
| InChI Key | HTGMODSTGYKJDG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C19H13Cl1O1 |
| Molecular Weight | 292.07 |
| AlogP | 5.32 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 21.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 42506-03-6 |
| NORMAN SUSDAT | |
| FDA SRS | 3DJX63N6JH |
| PubChem | 170655 |
| ChemSpider | 149200.0 |