| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | GF8ZKM9RKS |
| EPA CompTox | DTXSID30184024 |
Structure
| InChI Key | LBQMIAVIGLLBGW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H4F2O2 |
| Molecular Weight | 158.02 |
| AlogP | 1.66 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 37.3 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2991-28-8 |
| NORMAN SUSDAT | |
| FDA SRS | GF8ZKM9RKS |
| PubChem | 76339 |
| ChemSpider | 68816.0 |
CONTENTS
