| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID3074579 |
| InChI Key | TYOOXFQTUDXXCL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H18O2 |
| Molecular Weight | 170.13 |
| AlogP | 2.54 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 12.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 54410-94-5 |
| NORMAN SUSDAT | |
| PubChem | 549297 |
| ChemSpider | 477941.0 |