| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID40203573 |
| InChI Key | QSEWGOVLIQAGQY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H8Br1N1O4 |
| Molecular Weight | 260.96 |
| AlogP | 2.37 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 61.6 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 55034-12-3 |
| NORMAN SUSDAT | |
| PubChem | 3016927 |
| ChemSpider | 2284772.0 |