| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID10156668 |
| InChI Key | ROCVGJLXIARCAC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C6H7N1O2 |
| Molecular Weight | 125.05 |
| AlogP | 0.68 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Polar Surface Area | 66.48 |
| Heavy Atoms | 9.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 13066-95-0 |
| NORMAN SUSDAT | |
| PubChem | 432827 |
| ChemSpider | 66961.0 |