[2-(octanoyloxymethyl)-3-(3-sulfanylpropanoyloxy)-2-(3-sulfanylpropanoyloxymethyl)propyl] octanoate
[CAS# 96692-62-5]

Identification

• Name: [2-(octanoyloxymethyl)-3-(3-sulfanylpropanoyloxy)-2-(3-sulfanylpropanoyloxymethyl)propyl] octanoate
• Synonyms: 2,2-bis[(3-mercapto-1-oxopropoxy)methyl]-1,3-propanediyl dioctanoate
• Molecular Formula: C₂₇H₄₈O₈S₂
• Molecular Weight: 564.79
• CAS Registry Number: 96692-62-5
• EINECS: 306-281-9
• SMILES: O=C(OCC(COC(=O)CCS)(COC(=O)CCCCCCC)COC(=O)CCCCCCC)CCS
• InChI: 1S/C27H48O8S2/c1-3-5-7-9-11-13-23(28)32-19-27(21-34-25(30)15-17-36,22-35-26(31)16-18-37)20-33-24(29)14-12-10-8-6-4-2/h36-37H,3-22H2,1-2H3
• InChIKey: CSHJDPGSPSZKHR-UHFFFAOYSA-N

Properties

• Density: 1.094g/cm³ (Cal.)
• Boiling point: 629.462°C at 760 mmHg (Cal.)
• Flash point: 473.239°C (Cal.)