| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 4PXW1B04HJ |
| EPA CompTox | DTXSID6069111 |
Structure
| InChI Key | AFFZTFNQQHNSEG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H5F3O2 |
| Molecular Weight | 154.02 |
| AlogP | 1.63 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 56487-95-7 |
| NORMAN SUSDAT | |
| FDA SRS | 4PXW1B04HJ |
| PubChem | 91889 |
| ChemSpider | 82972.0 |
CONTENTS
