| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID10160684 |
| InChI Key | KGJWCQOEERZJMB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7F12O2 |
| Molecular Weight | 343.97 |
| AlogP | 4.91 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 18.46 |
| Heavy Atoms | 21.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 13846-22-5 |
| NORMAN SUSDAT | |
| PubChem | 83771 |
| ChemSpider | 75592.0 |