| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | KEL2VE23DC |
| EPA CompTox | DTXSID2074827 |
| InChI Key | XGXUGXPKRBQINS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H6Br2O1 |
| Molecular Weight | 263.88 |
| AlogP | 3.22 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 21702-84-1 |
| NORMAN SUSDAT | |
| FDA SRS | KEL2VE23DC |
| PubChem | 27011 |
| ChemSpider | 25152.0 |