| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | CNV9DH4SXQ |
| EPA CompTox | DTXSID80174591 |
| InChI Key | VCYBVWFTGAZHGH-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H7N1O2 |
| Molecular Weight | 161.05 |
| AlogP | 0.85 |
| Hydrogen Bond Acceptor | 2.0 |
| Polar Surface Area | 37.38 |
| Heavy Atoms | 12.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 2058-74-4 |
| NORMAN SUSDAT | |
| FDA SRS | CNV9DH4SXQ |
| PubChem | 16358 |
| ChemSpider | 15517.0 |