| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 320UN7XZYN |
| EPA CompTox | DTXSID00173187 |
| InChI Key | LMIQERWZRIFWNZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H7N1O1 |
| Molecular Weight | 133.05 |
| AlogP | 1.87 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 2.0 |
| Polar Surface Area | 36.02 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 1953-54-4 |
| NORMAN SUSDAT | |
| FDA SRS | 320UN7XZYN |
| PubChem | 16054 |
| ChemSpider | 15244.0 |