| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | JZ7GFC4MN9 |
| EPA CompTox | DTXSID4060733 |
| InChI Key | UALKQROXOHJHFG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H12O1 |
| Molecular Weight | 136.09 |
| AlogP | 2.39 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 621-32-9 |
| NORMAN SUSDAT | |
| FDA SRS | JZ7GFC4MN9 |
| PubChem | 69305 |
| ChemSpider | 62516.0 |