| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | JLY7K2SJEK |
| EPA CompTox | DTXSID5028031 |
Structure
| InChI Key | YNQSILKYZQZHFJ-UHFFFAOYNA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H13Cl2N1O2 |
| Molecular Weight | 225.03 |
| AlogP | 1.77 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 29.54 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 52836-31-4 |
| NORMAN SUSDAT | |
| FDA SRS | JLY7K2SJEK |
| ChemSpider | 55866.0 |
CONTENTS
