2,3-Bis(8-Butyloctadecanoyloxy)Propyl 2-Trimethylazaniumylethyl Phosphate
[CAS# 114928-03-9]

Identification

• Name: 2,3-Bis(8-Butyloctadecanoyloxy)Propyl 2-Trimethylazaniumylethyl Phosphate
• Synonyms: 2,3-Bis(8-Butyloctadecanoyloxy)Propyl 2-Trimethylammonioethyl Phosphate; 2,3-Bis(8-Butyl-1-Oxooctadecoxy)Propyl 2-Trimethylammonioethyl Phosphate; 3,5,9-Trioxa-4-Phosphaheptacosan-1-Aminium, 17-Butyl-7-((8-Butyl-1-Oxooctadecyl)Oxy)-4-Hydroxy-N,N,N-Trimethyl-10-Oxo-, Hydroxide, Inner Salt, 4-Oxide
• Molecular Formula: C₅₂H₁₀₄NO₈P
• Molecular Weight: 902.37
• CAS Registry Number: 114928-03-9
• SMILES: C(O[P](OCC[N+](C)(C)C)([O-])=O)C(OC(=O)CCCCCCC(CCCCCCCCCC)CCCC)COC(=O)CCCCCCC(CCCCCCCCCC)CCCC
• InChI: 1S/C52H104NO8P/c1-8-12-16-18-20-22-24-30-38-48(36-14-10-3)40-32-26-28-34-42-51(54)58-46-50(47-60-62(56,57)59-45-44-53(5,6)7)61-52(55)43-35-29-27-33-41-49(37-15-11-4)39-31-25-23-21-19-17-13-9-2/h48-50H,8-47H2,1-7H3
• InChIKey: VLVOBXXQNILUKL-UHFFFAOYSA-N