3-[(13Z)-13-Docosenoyloxy]-2,2-bis{[(13Z)-13-docosenoyloxy]methyl}propyl (13Z)-13-docosenoate
[CAS# 83198-00-9]

Identification

• Name: 3-[(13Z)-13-Docosenoyloxy]-2,2-bis{[(13Z)-13-docosenoyloxy]methyl}propyl (13Z)-13-docosenoate
• Synonyms: (Z,Z)-2,2-bis[(docos-13-enoyloxy)methyl]propane-1,3-diyl bis[(Z)-docos-13-enoate]
• Molecular Formula: C₉₃H₁₇₂O₈
• Molecular Weight: 1418.36
• CAS Registry Number: 83198-00-9
• EINECS: 280-211-4
• SMILES: O=C(OCC(COC(=O)CCCCCCCCCCC/C=C\CCCCCCCC)(COC(=O)CCCCCCCCCCC/C=C\CCCCCCCC)COC(=O)CCCCCCCCCCC/C=C\CCCCCCCC)CCCCCCCCCCC/C=C\CCCCCCCC
• InChI: 1S/C93H172O8/c1-5-9-13-17-21-25-29-33-37-41-45-49-53-57-61-65-69-73-77-81-89(94)98-85-93(86-99-90(95)82-78-74-70-66-62-58-54-50-46-42-38-34-30-26-22-18-14-10-6-2,87-100-91(96)83-79-75-71-67-63-59-55-51-47-43-39-35-31-27-23-19-15-11-7-3)88-101-92(97)84-80-76-72-68-64-60-56-52-48-44-40-36-32-28-24-20-16-12-8-4/h33-40H,5-32,41-88H2,1-4H3/b37-33-,38-34-,39-35-,40-36-
• InChIKey: XWLKYNBYAKPWTA-PMDAXIHYSA-N

Properties

• Density: 0.914g/cm³ (Cal.)
• Boiling point: 1107.272°C at 760 mmHg (Cal.)
• Flash point: 361.853°C (Cal.)