| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 4H8021R61U |
| EPA CompTox | DTXSID80188239 |
| InChI Key | AORIUCNKPVHMTN-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C15H14O2 |
| Molecular Weight | 226.1 |
| AlogP | 2.99 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 17.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 3469-00-9 |
| NORMAN SUSDAT | |
| FDA SRS | 4H8021R61U |
| PubChem | 77019 |
| ChemSpider | 69465.0 |