Toloconium Metilsulfate
[CAS# 552-92-1]

Identification

• Name: Toloconium Metilsulfate
• Synonyms: Methyl Sulfate; Trimethyl-[1-(P-Tolyl)Dodecyl]Ammonium; Metilsulfate De Toloconium [Inn-French]
• Molecular Formula: C₂₃H₄₃NO₄S
• Molecular Weight: 429.66
• CAS Registry Number: 552-92-1
• EINECS: 209-026-9
• SMILES: C1=C(C(CCCCCCCCCCC)[N+](C)(C)C)C=CC(=C1)C.CO[S](=O)(=O)[O-]
• InChI: 1S/C22H40N.CH4O4S/c1-6-7-8-9-10-11-12-13-14-15-22(23(3,4)5)21-18-16-20(2)17-19-21;1-5-6(2,3)4/h16-19,22H,6-15H2,1-5H3;1H3,(H,2,3,4)/q+1;/p-1
• InChIKey: RCIULPORFWIVEE-UHFFFAOYSA-M