1-[2-[(2-Cyanoethyl)(1-Oxooctadecyl)Amino]Ethyl]-2-Heptadecyl-4,5-Dihydro-1-Methyl-1H-Imidazolium Methyl Sulphate
[CAS# 67874-18-4]

Identification

• Name: 1-[2-[(2-Cyanoethyl)(1-Oxooctadecyl)Amino]Ethyl]-2-Heptadecyl-4,5-Dihydro-1-Methyl-1H-Imidazolium Methyl Sulphate
• Synonyms: N-(2-Cyanoethyl)-N-[2-(2-Heptadecyl-1-Methyl-4,5-Dihydroimidazol-1-Ium-1-Yl)Ethyl]Stearamide; Methyl Sulfate; 1-(2-((2-Cyanoethyl)(1-Oxooctadecyl)Amino)Ethyl)-2-Heptadecyl-4,5-Dihydro-1-Methyl-1H-Imidazolium Methyl Sulphate
• Molecular Formula: C₄₅H₈₈N₄O₅S
• Molecular Weight: 797.27
• CAS Registry Number: 67874-18-4
• EINECS: 267-457-8
• SMILES: CO[S]([O-])(=O)=O.C([N+]1(C(=NCC1)CCCCCCCCCCCCCCCCC)C)CN(C(=O)CCCCCCCCCCCCCCCCC)CCC#N
• InChI: 1S/C44H85N4O.CH4O4S/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-35-43-46-38-41-48(43,3)42-40-47(39-34-37-45)44(49)36-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2;1-5-6(2,3)4/h4-36,38-42H2,1-3H3;1H3,(H,2,3,4)/q+1;/p-1
• InChIKey: JRNQTQQWVNRAFK-UHFFFAOYSA-M