Ethylbis[2-(Oleoylamino)Ethyl]Ammonium Ethyl Sulphate
[CAS# 67846-12-2]

Identification

• Name: Ethylbis[2-(Oleoylamino)Ethyl]Ammonium Ethyl Sulphate
• Synonyms: Ethyl Hydrogen Sulfate; (Z)-N-[2-[Ethyl-[2-[[(Z)-1-Oxooctadec-9-Enyl]Amino]Ethyl]Amino]Ethyl]Octadec-9-Enamide; Sulfuric Acid, Monoethyl Ester, Compd. With (9Z,9'Z)-N,N'-((Ethylimino)Di-2,1-Ethanediyl)Bis(9-Octadecenamide) (1:1)
• Molecular Formula: C₄₄H₈₇N₃O₆S
• Molecular Weight: 786.25
• CAS Registry Number: 67846-12-2
• EINECS: 267-357-4
• SMILES: C(O[S](=O)(=O)O)C.C(N(CCNC(=O)CCCCCCC\C=C/CCCCCCCC)CC)CNC(=O)CCCCCCC\C=C/CCCCCCCC
• InChI: 1S/C42H81N3O2.C2H6O4S/c1-4-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-41(46)43-37-39-45(6-3)40-38-44-42(47)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-5-2;1-2-6-7(3,4)5/h19-22H,4-18,23-40H2,1-3H3,(H,43,46)(H,44,47);2H2,1H3,(H,3,4,5)/b21-19-,22-20-
• InChIKey: ZYVBAZSLDBUEAZ-JDVCJPALSA-N

Properties

• Boiling point: 770.8°C at 760 mmHg (Cal.)
• Flash point: 419.9°C (Cal.)