1,3-Dioleoyl-2-(4-Pyrenylbutanoyl)Glycerol
[CAS# 80749-89-9]

Identification

• Name: 1,3-Dioleoyl-2-(4-Pyrenylbutanoyl)Glycerol
• Synonyms: (Z)-Octadec-9-Enoic Acid [3-[(Z)-1-Oxooctadec-9-Enoxy]-2-[1-Oxo-4-(1-Pyrenyl)Butoxy]Propyl] Ester; (Z)-Octadec-9-Enoic Acid [3-[(Z)-Octadec-9-Enoyl]Oxy-2-(4-Pyren-1-Ylbutanoyloxy)Propyl] Ester; 1,3-Dioleoyl-2-(4-Pyrenylbutanoyl)Glycerol
• Molecular Formula: C₅₉H₈₆O₆
• Molecular Weight: 891.32
• CAS Registry Number: 80749-89-9
• SMILES: C1=CC2=CC=C3C=CC=C4C=CC(=C1CCCC(OC(COC(CCCCCCC\C=C/CCCCCCCC)=O)COC(CCCCCCC\C=C/CCCCCCCC)=O)=O)C2=C34
• InChI: 1S/C59H86O6/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-38-55(60)63-47-53(48-64-56(61)39-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)65-57(62)40-34-35-49-41-42-52-44-43-50-36-33-37-51-45-46-54(49)59(52)58(50)51/h17-20,33,36-37,41-46,53H,3-16,21-32,34-35,38-40,47-48H2,1-2H3/b19-17-,20-18-
• InChIKey: IGXQQAHHUHIOSW-CLFAGFIQSA-N

Properties

• Density: 1.025g/cm³ (Cal.)
• Boiling point: 866.477°C at 760 mmHg (Cal.)
• Flash point: 325.121°C (Cal.)