| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | CXR7Y955QE |
| EPA CompTox | DTXSID40191022 |
Structure
| InChI Key | AHRFMMRLDGAHBM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H8Cl2O2 |
| Molecular Weight | 169.99 |
| AlogP | 1.74 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 37587-81-8 |
| NORMAN SUSDAT | |
| FDA SRS | CXR7Y955QE |
| PubChem | 123461 |
| ChemSpider | 110057.0 |
CONTENTS
