| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | B9K240ZU36 |
| EPA CompTox | DTXSID50928629 |
| InChI Key | HIOMEXREAUSUBP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H16O2 |
| Molecular Weight | 168.12 |
| AlogP | 2.09 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 29.6 |
| Heavy Atoms | 12.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 134454-31-2 |
| NORMAN SUSDAT | |
| FDA SRS | B9K240ZU36 |