Calcium 2-Nonadecan-2-Ylbenzenesulphonate
[CAS# 94248-25-6]

Identification

• Name: Calcium 2-Nonadecan-2-Ylbenzenesulphonate
• Synonyms: Calcium 2-(1-Methyloctadecyl)Benzenesulfonate; Calcium Methyloctadecylbenzenesulphonate
• Molecular Formula: C₂₅H₄₃CaO₃S
• Molecular Weight: 463.75
• CAS Registry Number: 94248-25-6
• EINECS: 304-298-6
• SMILES: C1=CC=CC(=C1[S]([O-])(=O)=O)C(CCCCCCCCCCCCCCCCC)C.[Ca++]
• InChI: 1S/C25H44O3S.Ca/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23(2)24-21-18-19-22-25(24)29(26,27)28;/h18-19,21-23H,3-17,20H2,1-2H3,(H,26,27,28);/q;+2/p-1
• InChIKey: OZAJMAKLMQDBGV-UHFFFAOYSA-M