| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | AH74GPR4IK |
| EPA CompTox | DTXSID9062433 |
| InChI Key | OLXYLDUSSBULGU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H7N1O2 |
| Molecular Weight | 137.05 |
| AlogP | 0.87 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 39.19 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 2459-09-8 |
| NORMAN SUSDAT | |
| FDA SRS | AH74GPR4IK |
| PubChem | 227085 |
| ChemSpider | 16241.0 |