| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | Z3YN345K2L |
| EPA CompTox | DTXSID1069669 |
| InChI Key | PVDDBRQEFFELHC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H5Cl2N1O4 |
| Molecular Weight | 248.96 |
| AlogP | 2.69 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 69.44 |
| Heavy Atoms | 15.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 63105-52-2 |
| NORMAN SUSDAT | |
| FDA SRS | Z3YN345K2L |
| PubChem | 113008 |
| ChemSpider | 101287.0 |