| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID00379884 |
| InChI Key | BKXKCZGEIQKTBI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H5F11O1 |
| Molecular Weight | 326.02 |
| AlogP | 3.88 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 12.53 |
| Heavy Atoms | 20.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 54009-81-3 |
| NORMAN SUSDAT | |
| PubChem | 2776200 |
| ChemSpider | 2056521.0 |