| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 7BQ2R2LV8R |
| EPA CompTox | DTXSID60185887 |
| InChI Key | OCCIGHIQVMLYBZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H9N1O3 |
| Molecular Weight | 155.06 |
| AlogP | 1.16 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 52.33 |
| Heavy Atoms | 11.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 3209-72-1 |
| NORMAN SUSDAT | |
| FDA SRS | 7BQ2R2LV8R |
| PubChem | 76677 |
| ChemSpider | 69138.0 |