| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 50AIF51OCI |
| EPA CompTox | DTXSID2051689 |
| InChI Key | WGAVDEVFJDQIMZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H10O2 |
| Molecular Weight | 126.07 |
| AlogP | 0.8 |
| Hydrogen Bond Acceptor | 2.0 |
| Polar Surface Area | 34.14 |
| Heavy Atoms | 9.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 13494-06-9 |
| NORMAN SUSDAT | |
| FDA SRS | 50AIF51OCI |
| PubChem | 61633 |
| ChemSpider | 55541.0 |