| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | U4UPA3J2CR |
| EPA CompTox | DTXSID9060601 |
Structure
| InChI Key | RUSMDMDNFUYZTM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H6Cl1N1 |
| Molecular Weight | 163.02 |
| AlogP | 2.89 |
| Hydrogen Bond Acceptor | 1.0 |
| Polar Surface Area | 12.89 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 611-33-6 |
| NORMAN SUSDAT | |
| FDA SRS | U4UPA3J2CR |
| PubChem | 69139 |
| ChemSpider | 62355.0 |
CONTENTS
