| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID00420183 |
Structure
| InChI Key | IROWIXYGGPOJFJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H1Cl5O1 |
| Molecular Weight | 275.85 |
| AlogP | 4.68 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 42221-52-3 |
| NORMAN SUSDAT | |
| PubChem | 5463797 |
| ChemSpider | 4576359.0 |
CONTENTS
