| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | HV572LY7S8 |
| EPA CompTox | DTXSID2071867 |
| InChI Key | NLBLNZDNOSSGPW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H3Br7O1 |
| Molecular Weight | 715.45 |
| AlogP | 8.82 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 20.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 68928-80-3 |
| NORMAN SUSDAT | |
| FDA SRS | HV572LY7S8 |
| PubChem | 3034400 |
| ChemSpider | 2298869.0 |