| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| InChI Key | BCXSFFOHQBIFOM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C22H20Br1Cl1O2 |
| Molecular Weight | 430.03 |
| AlogP | 6.81 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 18.46 |
| Heavy Atoms | 26.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 1298086-15-3 |
| NORMAN SUSDAT | |
| PubChem | 67153917 |
| ChemSpider | 38003614.0 |