| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | GKV85F2ZXL |
| EPA CompTox | DTXSID0022228 |
| InChI Key | YEVPHFIFGUWSMG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H6Cl1N1O3 |
| Molecular Weight | 199.0 |
| AlogP | 2.45 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 60.21 |
| Heavy Atoms | 13.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 5465-65-6 |
| NORMAN SUSDAT | |
| FDA SRS | GKV85F2ZXL |
| PubChem | 79596 |
| ChemSpider | 11910.0 |