| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 71ARG7SMX7 |
| EPA CompTox | DTXSID80203673 |
| InChI Key | VRODDNARFBDTNM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H8Br1Cl1O1 |
| Molecular Weight | 233.94 |
| AlogP | 3.07 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 11.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 55162-34-0 |
| NORMAN SUSDAT | |
| FDA SRS | 71ARG7SMX7 |
| PubChem | 108680 |
| ChemSpider | 97722.0 |