| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID00170111 |
| InChI Key | XHDJYQWGFIBCEP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H4Cl1N1O2 |
| Molecular Weight | 180.99 |
| AlogP | 1.47 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 46.17 |
| Heavy Atoms | 12.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 17630-76-1 |
| NORMAN SUSDAT | |
| PubChem | 87203 |
| ChemSpider | 78664.0 |