| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 7GK69H2R84 |
| EPA CompTox | DTXSID30165510 |
| InChI Key | GUARKOVVHJSMRW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H12O2 |
| Molecular Weight | 128.08 |
| AlogP | 1.19 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 34.14 |
| Heavy Atoms | 9.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 1540-34-7 |
| NORMAN SUSDAT | |
| FDA SRS | 7GK69H2R84 |
| PubChem | 73761 |
| ChemSpider | 66401.0 |