| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 2H7AZ76A5R |
| EPA CompTox | DTXSID10169758 |
| InChI Key | VSPOTMOYDHRALZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H9N1O3 |
| Molecular Weight | 179.06 |
| AlogP | 2.19 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 60.21 |
| Heavy Atoms | 13.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 17408-16-1 |
| NORMAN SUSDAT | |
| FDA SRS | 2H7AZ76A5R |
| PubChem | 87096 |
| ChemSpider | 78563.0 |