| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | W96MUY2Q2J |
| EPA CompTox | DTXSID80180930 |
Structure
| InChI Key | DASJDMQCPIDJIF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H5Br1Cl2O1 |
| Molecular Weight | 265.89 |
| AlogP | 3.57 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2631-72-3 |
| NORMAN SUSDAT | |
| FDA SRS | W96MUY2Q2J |
| PubChem | 75828 |
| ChemSpider | 68337.0 |
CONTENTS
