| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 27MIP05EAV |
| EPA CompTox | DTXSID0060561 |
Structure
| InChI Key | SSIZLKDLDKIHEV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H4Br2O1 |
| Molecular Weight | 249.86 |
| AlogP | 2.92 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 608-33-3 |
| NORMAN SUSDAT | |
| FDA SRS | 27MIP05EAV |
| PubChem | 11847 |
| ChemSpider | 11354.0 |
CONTENTS
