| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 7A4R3CQA2T |
| EPA CompTox | DTXSID80858788 |
| InChI Key | DTCCTIQRPGSLPT-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C5H8O1 |
| Molecular Weight | 84.06 |
| AlogP | 1.15 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 6.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 1576-87-0 |
| NORMAN SUSDAT | |
| FDA SRS | 7A4R3CQA2T |
| PubChem | 12993 |
| ChemSpider | 12452.0 |