| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | L54H5WG7HG |
| EPA CompTox | DTXSID70192441 |
| InChI Key | KJCVCRCYCOWPFY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H6F1N1O4 |
| Molecular Weight | 199.03 |
| AlogP | 1.52 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 69.44 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 392-09-6 |
| NORMAN SUSDAT | |
| FDA SRS | L54H5WG7HG |
| PubChem | 3013872 |
| ChemSpider | 2282443.0 |