20,21-Di-8-heptadecen-1-yl 1,2,11-trioctadecyl 2,11,20-trihydroxy-6,15-dimethyl-4,9,13,18-tetraoxo-5,8,14,17-tetraoxahenicosane-1,2,11,20,21-pentacarboxylate
[CAS# 85049-94-1]

Identification

• Name: 20,21-Di-8-heptadecen-1-yl 1,2,11-trioctadecyl 2,11,20-trihydroxy-6,15-dimethyl-4,9,13,18-tetraoxo-5,8,14,17-tetraoxahenicosane-1,2,11,20,21-pentacarboxylate
• Synonyms: 1-heptadec-8-enyl 23-octadecyl 3-[(heptadec-8-enyloxy)carbonyl]-3,12,21-trihydroxy-8,17-dimethyl-12,21-bis[(octadecyloxy)carbonyl]-5,10,14,19-tetraoxo-6,9,15,18-tetraoxatricosanedioate
• Molecular Formula: C₁₁₂H₂₀₄O₂₁
• Molecular Weight: 1886.81
• CAS Registry Number: 85049-94-1
• EINECS: 285-267-3
• SMILES: CCCCCCCCC=CCCCCCCCOC(=O)C(O)(CC(=O)OCCCCCCCC=CCCCCCCCC)CC(=O)OCC(C)OC(=O)CC(O)(CC(=O)OCC(C)OC(=O)CC(O)(CC(=O)OCCCCCCCCCCCCCCCCCC)C(=O)OCCCCCCCCCCCCCCCCCC)C(=O)OCCCCCCCCCCCCCCCCCC
• InChI: 1S/C112H204O21/c1-8-13-18-23-28-33-38-43-48-53-57-62-67-72-77-82-87-126-102(114)92-111(123,108(120)128-89-84-79-74-69-64-59-54-49-44-39-34-29-24-19-14-9-2)95-105(117)132-100(7)98-131-104(116)94-112(124,109(121)129-90-85-80-75-70-65-60-55-50-45-40-35-30-25-20-15-10-3)96-106(118)133-99(6)97-130-103(115)93-110(122,107(119)127-88-83-78-73-68-63-58-52-47-42-37-32-27-22-17-12-5)91-101(113)125-86-81-76-71-66-61-56-51-46-41-36-31-26-21-16-11-4/h46-47,51-52,99-100,122-124H,8-45,48-50,53-98H2,1-7H3
• InChIKey: DSLLWPUAZZASBV-UHFFFAOYSA-N

Properties

• Density: 0.999g/cm³ (Cal.)
• Boiling point: 1264.077°C at 760 mmHg (Cal.)
• Flash point: 259.868°C (Cal.)