Behenalkonium chloride

CAS Registry Number®

16841-14-8

CAS Name

Behenalkonium chloride

Molecular Formula

C31H58N.Cl

Cite this Page

Behenalkonium chloride.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=16841-14-8 (retrieved 2024-11-22) (CAS RN: 16841-14-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C31H58N.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-26-29-32(2,3)30-31-27-24-23-25-28-31;/h23-25,27-28H,4-22,26,29-30H2,1-3H3;1H/q+1;/p-1

InChIKey

InChIKey=BWNMWDJZWBEKKJ-UHFFFAOYSA-M

SMILES

C([N+](CCCCCCCCCCCCCCCCCCCCCC)(C)C)C1=CC=CC=C1.[Cl-]

Canonical SMILES

[Cl-].C=1C=CC(=CC1)C[N+](C)(C)CCCCCCCCCCCCCCCCCCCCCC

Other Names for this Substance

  • Benzenemethanaminium, N-docosyl-N,N-dimethyl-, chloride (1:1)
  • Ammonium, benzyldocosyldimethyl-, chloride
  • Benzenemethanaminium, N-docosyl-N,N-dimethyl-, chloride
  • Dimethylbenzylbehenylammonium chloride
  • Behenylbenzyl dimethylammonium chloride

View All