p-Toluenesulfonic Acid Hexadecyl Ester
[CAS# 6068-28-6]

Identification

• Name: p-Toluenesulfonic Acid Hexadecyl Ester
• Synonyms: 4-Methylbenzenesulfonic Acid Hexadecyl Ester; 4-Methylbenzenesulfonic Acid Cetyl Ester; Nsc229435
• Molecular Formula: C₂₃H₄₀O₃S
• Molecular Weight: 396.63
• CAS Registry Number: 6068-28-6
• SMILES: C1=C(C=CC(=C1)C)[S](OCCCCCCCCCCCCCCCC)(=O)=O
• InChI: 1S/C23H40O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-26-27(24,25)23-19-17-22(2)18-20-23/h17-20H,3-16,21H2,1-2H3
• InChIKey: RXHIZFMFPLHZDT-UHFFFAOYSA-N

Properties

• Density: 0.988g/cm³ (Cal.)
• Boiling point: 497.029°C at 760 mmHg (Cal.)
• Flash point: 254.394°C (Cal.)