| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 96C2WU8832 |
| EPA CompTox | DTXSID3039400 |
| InChI Key | KZCBXHSWMMIEQU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H2Cl4O4 |
| Molecular Weight | 301.87 |
| AlogP | 3.7 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 74.6 |
| Heavy Atoms | 16.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 2136-79-0 |
| NORMAN SUSDAT | |
| FDA SRS | 96C2WU8832 |
| PubChem | 16493 |
| ChemSpider | 15635.0 |