| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID50188165 |
| InChI Key | JZRCRCFPVAXHHQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C11H5F17O2 |
| Molecular Weight | 492.0 |
| AlogP | 5.86 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 9.0 |
| Polar Surface Area | 37.3 |
| Heavy Atoms | 30.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 34598-33-9 |
| NORMAN SUSDAT | |
| PubChem | 2782413 |
| ChemSpider | 2062568.0 |