| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID00192616 |
| InChI Key | RXQNKKRGJJRMKD-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H8Br1N1 |
| Molecular Weight | 184.98 |
| AlogP | 2.34 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 26.02 |
| Heavy Atoms | 9.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 39478-78-9 |
| NORMAN SUSDAT | |
| PubChem | 2734805 |
| ChemSpider | 10943.0 |