| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | PR8HC8LM73 |
| EPA CompTox | DTXSID20232826 |
Structure
| InChI Key | HQJQYDVEVAJKDJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H7Br5O2 |
| Molecular Weight | 553.64 |
| AlogP | 6.2 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 17.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 83929-71-9 |
| NORMAN SUSDAT | |
| FDA SRS | PR8HC8LM73 |
| PubChem | 3019503 |
| ChemSpider | 2286696.0 |
CONTENTS
