| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 54KF47MNE6 |
| EPA CompTox | DTXSID30177951 |
Structure
| InChI Key | GYDFVBYBCDOBFE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H7Cl3O1 |
| Molecular Weight | 223.96 |
| AlogP | 4.05 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 23399-88-4 |
| NORMAN SUSDAT | |
| FDA SRS | 54KF47MNE6 |
| PubChem | 90087 |
| ChemSpider | 81088.0 |
CONTENTS
