N,N,N-Trimethyl-2,3-Bis[(9Z)-9-Octadecenoyloxy]-1-Propanaminium Chloride
[CAS# 132172-61-3]

Identification

• Name: N,N,N-Trimethyl-2,3-Bis[(9Z)-9-Octadecenoyloxy]-1-Propanaminium Chloride
• Synonyms: "1,2-Dioleoyl-3-trimethylammoniumpropane (chloride)"; "1,2-dioleoyl-3-trimethylammoniumpropane, monochloride"; (2,3-Bis-octadec-9-enoyloxy-propyl)-trimethyl-ammonium
• Molecular Formula: C₄₂H₈₀ClNO₄
• Molecular Weight: 698.54
• CAS Registry Number: 132172-61-3
• SMILES: CCCCCCCC/C=C\CCCCCCCC(=O)OCC(C[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCCCCCC.[Cl-]
• InChI: 1S/C42H80NO4.ClH/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-41(44)46-39-40(38-43(3,4)5)47-42(45)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2;/h20-23,40H,6-19,24-39H2,1-5H3;1H/q+1;/p-1/b22-20-,23-21-
• InChIKey: KSXTUUUQYQYKCR-LQDDAWAPSA-M

Properties

• Refractive index: (Cal.)