Calcium p-dodecylbenzenesulfonate
calcium bis(4-dodecylbenzenesulfonate)
Also Known As: Calcium p-dodecylbenzenesulfonate|calcium 4-dodecylbenzenesulfonate|Calcium dodecylbenzene sulfonate|Jsp005168|calcium;4-dodecylbenzenesulfonate|CALCIUMDODECYLBENZENESULFONATE|Benzenesulfonic acid, 4-dodecyl-, calcium salt|calcium,4-dodecylbenzenesulfonic acid|C18-H30-O3-S.1/2Ca|Benzenesulfonic acid, dodecyl-, calcium salt|4-Dodecylbenzenesulfonic acid calcium salt|Bis(4-dodecylbenzenesulfonic acid)calcium salt|Calcium bis(4-dodecylbenzene-1-sulfonate)|Benzenesulfonic acid, 4-dodecyl-, calcium salt (2:1)
| Molecular Formula | C36H58CaO6S2 |
|---|---|
| Molecular Weight | 690.3301 g/mol |
| LogP | 9.7274 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 22 |
| Exact Mass | 690.3301 |
| Monoisotopic Mass | 690.3301 |
| Heavy Atoms | 45 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 26264-06-2 |
|---|---|
| SMILES | CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].[Ca+2] |
| InChIKey | IQAXZJZTCMIPCX-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Calcium p-dodecylbenzenesulfonate (CAS 26264-06-2), with molecular formula C36H58CaO6S2 and molecular weight 690.3301 g/mol. IUPAC: calcium bis(4-dodecylbenzenesulfonate).
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