| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID3071692 |
| InChI Key | CARKMBGHKLICNI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H11N1O2 |
| Molecular Weight | 177.08 |
| AlogP | 2.2 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 38.66 |
| Heavy Atoms | 13.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 68556-21-8 |
| NORMAN SUSDAT | |
| PubChem | 110591 |
| ChemSpider | 95611.0 |