(2-Hydroxyethyl)Methylbis[2-(Oleoyloxy)Ethyl]Ammonium Methyl Sulphate
[CAS# 97338-06-2]

Identification

• Name: (2-Hydroxyethyl)Methylbis[2-(Oleoyloxy)Ethyl]Ammonium Methyl Sulphate
• Synonyms: 3-Hydroxypropyl-Bis[2-[(Z)-Octadec-9-Enoyl]Oxyethyl]Ammonium; Methyl Sulfate; 3-Hydroxypropyl-Bis[2-[(Z)-1-Oxooctadec-9-Enoxy]Ethyl]Ammonium; Methyl Sulfate
• Molecular Formula: C₄₄H₈₅NO₉S
• Molecular Weight: 804.22
• CAS Registry Number: 97338-06-2
• EINECS: 306-600-1
• SMILES: CO[S]([O-])(=O)=O.C([NH+](CCOC(=O)CCCCCCC\C=C/CCCCCCCC)CCCO)COC(=O)CCCCCCC\C=C\CCCCCCCC
• InChI: 1S/C43H81NO5.CH4O4S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-34-42(46)48-40-37-44(36-33-39-45)38-41-49-43(47)35-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-5-6(2,3)4/h17-20,45H,3-16,21-41H2,1-2H3;1H3,(H,2,3,4)/b19-17-,20-18+
• InChIKey: AZOSBZNERHWPMK-QUVSZBQMSA-N

Properties

• Boiling point: 717.7°C at 760 mmHg (Cal.)
• Flash point: 387.9°C (Cal.)