| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 9VY0HXB11T |
| EPA CompTox | DTXSID20204881 |
Structure
| InChI Key | IEPBPSSCIZTJIF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H4Cl6O3 |
| Molecular Weight | 321.83 |
| AlogP | 3.88 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 35.53 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 5634-37-7 |
| NORMAN SUSDAT | |
| FDA SRS | 9VY0HXB11T |
CONTENTS
