| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID0065355 |
| InChI Key | FQEIBEOBXKJAMZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H7F3N2O1 |
| Molecular Weight | 204.05 |
| AlogP | 2.61 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 56.11 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 13114-87-9 |
| NORMAN SUSDAT | |
| PubChem | 25712 |
| ChemSpider | 23953.0 |