| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 3U2QK7J92A |
| EPA CompTox | DTXSID70215644 |
Structure
| InChI Key | UBDFNSASHPESJX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H5F5O |
| Molecular Weight | 212.03 |
| AlogP | 1.92 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 653-31-6 |
| NORMAN SUSDAT | |
| FDA SRS | 3U2QK7J92A |
| PubChem | 69555 |
CONTENTS
