| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 9Z68REL6UC |
| EPA CompTox | DTXSID00166115 |
| InChI Key | OQBCJXUAQQMTRW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C6H10O1 |
| Molecular Weight | 98.07 |
| AlogP | 1.38 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 7.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 1567-75-5 |
| NORMAN SUSDAT | |
| FDA SRS | 9Z68REL6UC |
| PubChem | 74067 |
| ChemSpider | 66685.0 |