| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | W7JWC6SR2L |
| EPA CompTox | DTXSID80218989 |
Structure
| InChI Key | ROPHHOGKCLJYID-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H10Cl2O4 |
| Molecular Weight | 228.0 |
| AlogP | 2.76 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 52.6 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 6892-17-7 |
| NORMAN SUSDAT | |
| FDA SRS | W7JWC6SR2L |
| PubChem | 81320 |
| ChemSpider | 73370.0 |
CONTENTS
