| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID70896614 |
Structure
| InChI Key | BSYZCTLPTCSJLJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5ClF9O |
| Molecular Weight | 281.95 |
| AlogP | 4.1 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 16.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 80962-91-0 |
| NORMAN SUSDAT | |
| PubChem | 6365807 |
CONTENTS
