| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | Q6JSC67949 |
| EPA CompTox | DTXSID90185971 |
Structure
| InChI Key | GZFYZMCWQKTEEW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C13H8ClF3NO3 |
| Molecular Weight | 317.01 |
| AlogP | 5.06 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 52.37 |
| Heavy Atoms | 21.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 322-75-8 |
| NORMAN SUSDAT | |
| FDA SRS | Q6JSC67949 |
| PubChem | 67581 |
CONTENTS
