| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID50880950 |
| InChI Key | PCNHGPSESDZSRB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H1F15O1 |
| Molecular Weight | 397.98 |
| AlogP | 4.92 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 24.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 71302-72-2 |
| NORMAN SUSDAT | |
| PubChem | 116761 |
| ChemSpider | 104370.0 |