| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 1T5D4K1V51 |
| EPA CompTox | DTXSID5044948 |
| InChI Key | JGBJHRKCUKTQOE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H6Cl1N1O4 |
| Molecular Weight | 215.0 |
| AlogP | 2.03 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 69.44 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 51282-49-6 |
| NORMAN SUSDAT | |
| FDA SRS | 1T5D4K1V51 |
| PubChem | 171018 |
| ChemSpider | 149513.0 |