| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID90191991 |
| InChI Key | GMZBZKVJMOEKGM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C4H7Br1O1 |
| Molecular Weight | 149.97 |
| AlogP | 1.36 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 6.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 38694-47-2 |
| NORMAN SUSDAT | |
| PubChem | 3016005 |
| ChemSpider | 2284025.0 |