| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 8V0T4VPX7O |
| EPA CompTox | DTXSID30182964 |
Structure
| InChI Key | ZFHKTQUHJNUDNH-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H3F11O1 |
| Molecular Weight | 312.0 |
| AlogP | 2.88 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 19.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 28788-68-3 |
| NORMAN SUSDAT | |
| FDA SRS | 8V0T4VPX7O |
| PubChem | 2782563 |
| ChemSpider | 2062717.0 |
CONTENTS
