| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | UVY9GCI1OV |
| EPA CompTox | DTXSID30200273 |
| InChI Key | MJKZGSBXCWNUHV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C17H12O2 |
| Molecular Weight | 248.08 |
| AlogP | 3.78 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 37.3 |
| Heavy Atoms | 19.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 52222-87-4 |
| NORMAN SUSDAT | |
| FDA SRS | UVY9GCI1OV |
| PubChem | 93271 |
| ChemSpider | 84204.0 |