chempirical

Octyldecyldimethylammonium chloride

C20H44ClNCAS 32426-11-2334.03 g/mol

Open in Covalent MOL file
N+Cl−
Quaternary ammonium

Properties

Molecular formula
C20H44ClN
Molar mass
334.03 g/mol
Exact mass
333.3162 Da
logP
3.57Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
16

Identifiers

CAS number
32426-11-2
SMILES
CCCCCCCCCC[N+](C)(C)CCCCCCCC.[Cl-]
InChIKey
SCXCDVTWABNWLW-UHFFFAOYSA-M
InChI
InChI=1S/C20H44N.ClH/c1-5-7-9-11-13-14-16-18-20-21(3,4)19-17-15-12-10-8-6-2;/h5-20H2,1-4H3;1H/q+1;/p-1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

9 names
  • 1-Decanaminium, N,N-dimethyl-N-octyl-, chloride (1:1)
  • Ammonium, decyldimethyloctyl-, chloride
  • 1-Decanaminium, N,N-dimethyl-N-octyl-, chloride
  • Decyldimethyloctylammonium chloride
  • Bardac 2050
  • Quaternium 24
  • Decyloctyldimethylammonium chloride
  • BTC 818
  • N-Octyl-N-decyl-N-dimethyl-ammonium chloride

Work with Octyldecyldimethylammonium chloride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Dimethyldioctadecylammonium chloride107-64-2100 % similar Dilauryldimethylammonium chloride3401-74-9100 % similar Dioctyldimethylammonium chloride5538-94-3100 % similar Didecyldimethylammonium chloride7173-51-5100 % similar Mepiquat chloride24307-26-475 % similar Didecyl dimethyl ammonium bromide2390-68-374 % similar Didodecyldimethylammonium bromide3282-73-374 % similar Dimethyldioctadecylammonium bromide3700-67-274 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Tetrapentylammonium chloride4965-17-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook