| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | S198602E40 |
| EPA CompTox | DTXSID5020445 |
Structure
| InChI Key | WHOKDONDRZNCBC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C11H12Cl2O3 |
| Molecular Weight | 262.02 |
| AlogP | 3.32 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 35.53 |
| Heavy Atoms | 16.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 94-11-1 |
| NORMAN SUSDAT | |
| FDA SRS | S198602E40 |
| PubChem | 7173 |
| ChemSpider | 6905.0 |
CONTENTS
