1-[[(1-Oxohexadecyl)Oxy]Methyl]-2-[(1-Oxooctadecyl)Oxy]Ethyl (E)-9-Octadecenoate
[CAS# 94481-68-2]

Identification

• Name: 1-[[(1-Oxohexadecyl)Oxy]Methyl]-2-[(1-Oxooctadecyl)Oxy]Ethyl (E)-9-Octadecenoate
• Synonyms: [1-(Hexadecanoyloxymethyl)-2-Octadecanoyloxy-Ethyl] (E)-Octadec-9-Enoate; (E)-Octadec-9-Enoic Acid [1-(1-Oxohexadecoxymethyl)-2-(1-Oxooctadecoxy)Ethyl] Ester; (E)-Octadec-9-Enoic Acid [1-(Hexadecanoyloxymethyl)-2-Stearoyloxy-Ethyl] Ester
• Molecular Formula: C₅₅H₁₀₄O₆
• Molecular Weight: 861.42
• CAS Registry Number: 94481-68-2
• EINECS: 305-395-6
• SMILES: C(C(COC(CCCCCCCCCCCCCCC)=O)OC(CCCCCCC\C=C\CCCCCCCC)=O)OC(CCCCCCCCCCCCCCCCC)=O
• InChI: 1S/C55H104O6/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/h26,28,52H,4-25,27,29-51H2,1-3H3/b28-26+
• InChIKey: QXPXMOHHFYONAC-BYCLXTJYSA-N

Properties

• Density: 0.916g/cm³ (Cal.)
• Boiling point: 800.254°C at 760 mmHg (Cal.)
• Flash point: 297.304°C (Cal.)