| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | AK4DQ3EL7A |
| EPA CompTox | DTXSID2060464 |
| InChI Key | MMYKTRPLXXWLBC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C4H9Br1O1 |
| Molecular Weight | 151.98 |
| AlogP | 1.42 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 6.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 592-55-2 |
| NORMAN SUSDAT | |
| FDA SRS | AK4DQ3EL7A |
| PubChem | 61141 |
| ChemSpider | 55088.0 |