| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | SN5N5MA34F |
| EPA CompTox | DTXSID2061983 |
Structure
| InChI Key | DODIKYQYCCFWRZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C13H8ClFO |
| Molecular Weight | 234.02 |
| AlogP | 3.71 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 16.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1806-23-1 |
| NORMAN SUSDAT | |
| FDA SRS | SN5N5MA34F |
| PubChem | 74547 |
CONTENTS
