| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 7BUC2LA7ME |
| EPA CompTox | DTXSID3065586 |
Structure
| InChI Key | VIEHKBXCWMMOOU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H7F7O2 |
| Molecular Weight | 268.03 |
| AlogP | 2.94 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 17.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 13695-31-3 |
| NORMAN SUSDAT | |
| FDA SRS | 7BUC2LA7ME |
| PubChem | 83666 |
| ChemSpider | 75489.0 |
CONTENTS
