| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID3068465 |
Structure
| InChI Key | CLISWDZSTWQFNX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H7F5O2 |
| Molecular Weight | 218.04 |
| AlogP | 2.3 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 45115-53-5 |
| NORMAN SUSDAT | |
| PubChem | 123516 |
| ChemSpider | 110111.0 |
CONTENTS
