| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | VMU0X6956Y |
| EPA CompTox | DTXSID9060449 |
Structure
| InChI Key | MNOJRWOWILAHAV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H5Br1O1 |
| Molecular Weight | 171.95 |
| AlogP | 2.15 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 591-20-8 |
| NORMAN SUSDAT | |
| FDA SRS | VMU0X6956Y |
| PubChem | 11563 |
| ChemSpider | 13875441.0 |
CONTENTS
