| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID60583425 |
| InChI Key | CQOQAOKSHAECHG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C17H11F17O1 |
| Molecular Weight | 554.05 |
| AlogP | 7.12 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 10.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 35.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 356055-77-1 |
| NORMAN SUSDAT | |
| PubChem | 16211438 |
| ChemSpider | 11575109.0 |