| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | ETK6FJ5FU9 |
| EPA CompTox | DTXSID8064430 |
| InChI Key | NDOPHXWIAZIXPR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H5Br1O1 |
| Molecular Weight | 183.95 |
| AlogP | 2.26 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 9.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 6630-33-7 |
| NORMAN SUSDAT | |
| FDA SRS | ETK6FJ5FU9 |
| PubChem | 81129 |
| ChemSpider | 119298.0 |