| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID60179807 |
| InChI Key | PFNAUBYHTWDKBO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H9N1O1 |
| Molecular Weight | 147.07 |
| AlogP | 1.96 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 33.02 |
| Heavy Atoms | 11.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 25117-75-3 |
| NORMAN SUSDAT | |
| PubChem | 91283 |
| ChemSpider | 81718.0 |