2-[(9Z)-9-Octadecenoyloxy]-3-(palmitoyloxy)propyl (9Z,12Z)-9,12-octadecadienoate
[CAS# 2680-59-3]

Identification

• Name: 2-[(9Z)-9-Octadecenoyloxy]-3-(palmitoyloxy)propyl (9Z,12Z)-9,12-octadecadienoate
• Synonyms: "3-[(1-oxohexadecyl)oxy]-2-[[(9Z)-1-oxo-9-octadecenyl]oxy]-9Z,12Z-octadecadienoic acid propyl ester"; 1-PALMITIN-2-OLEIN-3-LINOLEIN; 1-Palmitoyl-2-oleoyl-3-linoleoyl-rac-glycerol
• Molecular Formula: C₅₅H₁₀₀O₆
• Molecular Weight: 857.38
• CAS Registry Number: 2680-59-3
• SMILES: O=C(OCC(OC(=O)CCCCCCC/C=C\CCCCCCCC)COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)CCCCCCCCCCCCCCC
• InChI: 1S/C55H100O6/c1-4-7-10-13-16-19-22-25-27-30-33-36-39-42-45-48-54(57)60-51-52(50-59-53(56)47-44-41-38-35-32-29-24-21-18-15-12-9-6-3)61-55(58)49-46-43-40-37-34-31-28-26-23-20-17-14-11-8-5-2/h16,19,25-28,52H,4-15,17-18,20-24,29-51H2,1-3H3/b19-16-,27-25-,28-26-
• InChIKey: KGLAHZTWGPHKFF-FBSASISJSA-N

Properties

• Density: 0.924g/cm³ (Cal.)
• Boiling point: 801.418°C at 760 mmHg (Cal.)
• Flash point: 298.536°C (Cal.)
• Refractive index: 1.477 (Cal.)