Sorbitan, Triisooctadecanoate
[CAS# 54392-27-7]

Identification

• Name: Sorbitan, Triisooctadecanoate
• Synonyms: [(2R,3R,4S)-2-[(1R)-2-Hydroxy-1-(16-Methylheptadecanoyloxy)Ethyl]-4-(16-Methylheptadecanoyloxy)Tetrahydrofuran-3-Yl] 16-Methylheptadecanoate; 16-Methylheptadecanoic Acid [(2R,3R,4S)-2-[(1R)-2-Hydroxy-1-(16-Methyl-1-Oxoheptadecoxy)Ethyl]-4-(16-Methyl-1-Oxoheptadecoxy)-3-Tetrahydrofuranyl] Ester; 16-Methylheptadecanoic Acid [(2R,3R,4S)-2-[(1R)-2-Hydroxy-1-(16-Methylheptadecanoyloxy)Ethyl]-4-(16-Methylheptadecanoyloxy)Tetrahydrofuran-3-Yl] Ester
• Molecular Formula: C₆₀H₁₁₄O₈
• Molecular Weight: 963.56
• CAS Registry Number: 54392-27-7
• EINECS: 259-141-3
• SMILES: [C@@H]1(OC[C@H](OC(=O)CCCCCCCCCCCCCCC(C)C)[C@H]1OC(=O)CCCCCCCCCCCCCCC(C)C)[C@H](OC(=O)CCCCCCCCCCCCCCC(C)C)CO
• InChI: 1S/C60H114O8/c1-51(2)43-37-31-25-19-13-7-10-16-22-28-34-40-46-56(62)66-54(49-61)59-60(68-58(64)48-42-36-30-24-18-12-9-15-21-27-33-39-45-53(5)6)55(50-65-59)67-57(63)47-41-35-29-23-17-11-8-14-20-26-32-38-44-52(3)4/h51-55,59-61H,7-50H2,1-6H3/t54-,55+,59-,60-/m1/s1
• InChIKey: QWSHIYVIOOXKLL-LLPUSWRMSA-N

Properties

• Density: 0.967g/cm³ (Cal.)
• Boiling point: 881.905°C at 760 mmHg (Cal.)
• Flash point: 220.197°C (Cal.)