| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | N3H5SVZ7X2 |
| EPA CompTox | DTXSID20209179 |
| InChI Key | NJOPQQPDPYWFFA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H6Cl1N1O2 |
| Molecular Weight | 195.01 |
| AlogP | 1.5 |
| Hydrogen Bond Acceptor | 2.0 |
| Polar Surface Area | 37.38 |
| Heavy Atoms | 13.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 60434-13-1 |
| NORMAN SUSDAT | |
| FDA SRS | N3H5SVZ7X2 |
| PubChem | 108941 |
| ChemSpider | 97970.0 |