| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | JF8MPL73NZ |
| EPA CompTox | DTXSID9058995 |
| InChI Key | NWESJZZPAJGHRZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H6Cl1N1O2 |
| Molecular Weight | 171.01 |
| AlogP | 2.56 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 43.14 |
| Heavy Atoms | 11.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 89-60-1 |
| NORMAN SUSDAT | |
| FDA SRS | JF8MPL73NZ |
| PubChem | 6976 |
| ChemSpider | 6710.0 |