| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 2SH42J49JW |
| EPA CompTox | DTXSID60184456 |
| InChI Key | DRLDSHOYANTUND-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C11H5F17O2 |
| Molecular Weight | 492.0 |
| AlogP | 5.56 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 8.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 30.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 30377-52-7 |
| NORMAN SUSDAT | |
| FDA SRS | 2SH42J49JW |
| PubChem | 121681 |
| ChemSpider | 108571.0 |