| Keyword(s): | Human Metabolites |
| Molecule Category | Salt-form |
| EPA CompTox | DTXSID80583740 |
| InChI Key | ZBUXZWKNRXKPNV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H10F13N2 |
| Molecular Weight | 429.06 |
| AlogP | 4.44 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 8.81 |
| Heavy Atoms | 27.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 313475-50-2 |
| NORMAN SUSDAT | |
| PubChem | 16212940 |
| ChemSpider | 17340702.0 |