| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 46RP8EDN7J |
| EPA CompTox | DTXSID00162733 |
| InChI Key | GDGFDAKCWRGGHW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H18O1 |
| Molecular Weight | 178.14 |
| AlogP | 3.31 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 13.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 1445-23-4 |
| NORMAN SUSDAT | |
| FDA SRS | 46RP8EDN7J |
| PubChem | 74048 |
| ChemSpider | 66667.0 |