| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID4075322 |
| InChI Key | UUZYFBXKWIQKTF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H6Br1N1 |
| Molecular Weight | 194.97 |
| AlogP | 2.52 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 23.79 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 31938-07-5 |
| NORMAN SUSDAT | |
| PubChem | 36023 |
| ChemSpider | 33137.0 |