4,4-Bis(Dodecylthio)Pentanoic Acid
[CAS# 4200-61-7]

Identification

• Name: 4,4-Bis(Dodecylthio)Pentanoic Acid
• Synonyms: 4,4-Bis(Dodecylthio)Pentanoic Acid; 4,4-Bis(Laurylthio)Valeric Acid; Pentanoic Acid, 4,4-Bis(Dodecylthio)-
• Molecular Formula: C₂₉H₅₈O₂S₂
• Molecular Weight: 502.90
• CAS Registry Number: 4200-61-7
• SMILES: C(SC(SCCCCCCCCCCCC)(C)CCC(=O)O)CCCCCCCCCCC
• InChI: 1S/C29H58O2S2/c1-4-6-8-10-12-14-16-18-20-22-26-32-29(3,25-24-28(30)31)33-27-23-21-19-17-15-13-11-9-7-5-2/h4-27H2,1-3H3,(H,30,31)
• InChIKey: XWIMFKGLFGDSOG-UHFFFAOYSA-N

Properties

• Density: 0.949g/cm³ (Cal.)
• Boiling point: 604.547°C at 760 mmHg (Cal.)
• Flash point: 319.419°C (Cal.)