| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | KFP6EO4J6P |
| EPA CompTox | DTXSID4060941 |
| InChI Key | NPDIDUXTRAITDE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C13H12 |
| Molecular Weight | 168.09 |
| AlogP | 3.66 |
| Number of Rotational Bond | 1.0 |
| Heavy Atoms | 13.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 643-93-6 |
| NORMAN SUSDAT | |
| FDA SRS | KFP6EO4J6P |
| PubChem | 12564 |
| ChemSpider | 12045.0 |