| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID9064972 |
| InChI Key | AYMDJPGTQFHDSA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H16O3 |
| Molecular Weight | 160.11 |
| AlogP | 1.2 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 8.0 |
| Polar Surface Area | 27.69 |
| Heavy Atoms | 11.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 10143-53-0 |
| NORMAN SUSDAT | |
| PubChem | 25008 |
| ChemSpider | 23376.0 |