(E)-12-[(E)-18-Hydroxy-18-Oxooctadec-9-En-7-Yl]Oxyoctadec-9-Enoic Acid
[CAS# 79415-97-7]

Identification

• Name: (E)-12-[(E)-18-Hydroxy-18-Oxooctadec-9-En-7-Yl]Oxyoctadec-9-Enoic Acid
• Synonyms: (E)-12-[(E)-1-Hexyl-12-Hydroxy-12-Oxo-Dodec-3-Enoxy]Octadec-9-Enoic Acid; (E)-12-[(E)-1-Hexyl-12-Hydroxy-12-Oxododec-3-Enoxy]Octadec-9-Enoic Acid; (E)-12-[(E)-1-Hexyl-12-Hydroxy-12-Keto-Dodec-3-Enoxy]Octadec-9-Enoic Acid
• Molecular Formula: C₃₆H₆₆O₅
• Molecular Weight: 578.91
• CAS Registry Number: 79415-97-7
• SMILES: C(C(=O)O)CCCCCC\C=C\CC(OC(C/C=C/CCCCCCCC(=O)O)CCCCCC)CCCCCC
• InChI: 1S/C36H66O5/c1-3-5-7-21-27-33(29-23-17-13-9-11-15-19-25-31-35(37)38)41-34(28-22-8-6-4-2)30-24-18-14-10-12-16-20-26-32-36(39)40/h17-18,23-24,33-34H,3-16,19-22,25-32H2,1-2H3,(H,37,38)(H,39,40)/b23-17+,24-18+
• InChIKey: MAWLNCDEZPYQQL-GJHDBBOXSA-N

Properties

• Density: 0.955g/cm³ (Cal.)
• Boiling point: 645.767°C at 760 mmHg (Cal.)
• Flash point: 183.417°C (Cal.)