| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID60916633 |
| InChI Key | ILSWEUDQMRFOAY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C11H17BrO4 |
| Molecular Weight | 292.03 |
| AlogP | 2.21 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 8.0 |
| Polar Surface Area | 52.6 |
| Heavy Atoms | 16.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 94023-68-4 |
| NORMAN SUSDAT | |
| PubChem | 3023345 |