| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | CC4U9T2VQB |
| EPA CompTox | DTXSID80183365 |
Structure
| InChI Key | BXLHXHGCQFJTLA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H8F2O |
| Molecular Weight | 170.05 |
| AlogP | 2.56 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 29112-90-1 |
| NORMAN SUSDAT | |
| FDA SRS | CC4U9T2VQB |
| PubChem | 120137 |
CONTENTS
