HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-Piperazinebutanoic acid, 4-[(4-bromophenyl)sulfonyl]-γ-oxo-
1-Piperazinebutanoic acid, 4-[(4-bromophenyl)sulfonyl]-γ-oxo- · 4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-4-oxobutanoic acid · 4-[4-(4-Bromobenzenesulfonyl)piperazin-1-yl]-4-oxobutanoic acid
![1-Piperazinebutanoic acid, 4-[(4-bromophenyl)sulfonyl]-γ-oxo- molecular structure](/img/chemical/16637069.png)
Identifiers & Physical Properties
| CAS No. | 893725-68-3 |
|---|---|
| Molecular formula | C14H17BrN2O5S |
| Average molar mass | 405.26 g/mol |
| SMILES | O=C(O)CCC(=O)N1CCN(S(=O)(=O)c2ccc(Br)cc2)CC1 |
| InChIKey | SIKBSCDVAXWLKW-UHFFFAOYSA-N |
| PubChem CID | 16637069 |
| EC No. | 899-901-7 |
Chemical & Physical Properties
| Boiling point | 617.4±65.0 °C(Predicted) |
|---|---|
| Density | 1.615±0.06 g/cm3(Predicted) |
| pKa (acidity coefficient) | 4.98±0.17(Predicted) |