| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 8S1I71213X |
| EPA CompTox | DTXSID2060175 |
| InChI Key | FDQQNNZKEJIHMS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H12O1 |
| Molecular Weight | 136.09 |
| AlogP | 2.32 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 527-54-8 |
| NORMAN SUSDAT | |
| FDA SRS | 8S1I71213X |
| PubChem | 10696 |
| ChemSpider | 10246.0 |