chempirical

Diallyldimethylammonium chloride

C8H16ClNCAS 7398-69-8161.67 g/mol

Open in Covalent MOL file
N+Cl−
AlkeneQuaternary ammonium

Properties

Molecular formula
C8H16ClN
Molar mass
161.67 g/mol
Exact mass
161.0971 Da
Melting point
164–167 °C
logP
-1.56Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
4

Identifiers

CAS number
7398-69-8
SMILES
C=CC[N+](C)(C)CC=C.[Cl-]
InChIKey
GQOKIYDTHHZSCJ-UHFFFAOYSA-M
InChI
InChI=1S/C8H16N.ClH/c1-5-7-9(3,4)8-6-2;/h5-6H,1-2,7-8H2,3-4H3;1H/q+1;/p-1

Weigh it out

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

Names and synonyms

18 names · show all
  • 2-Propen-1-aminium, N,N-dimethyl-N-2-propen-1-yl-, chloride (1:1)
  • DADMAC
  • Ammonium, diallyldimethyl-, chloride
  • 2-Propen-1-aminium, N,N-dimethyl-N-2-propenyl-, chloride
  • Dimethyldiallylammonium chloride
  • N,N-Diallyl-N,N-dimethylammonium chloride
  • C 1615
  • Nalco 7544
  • C 1615M-BR 30
  • M-DADMAC
  • Nalco TX 13645
  • LYFM 205-65
  • Newfrontier C 1615
  • Hercules D 1259
  • D 1259
  • AG Fix M 80
  • FC 704
  • Flocryl 4007Q

Work with Diallyldimethylammonium 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

Allyltrimethylammonium chloride1516-27-464 % similar Polyquaternium-726590-05-647 % similar Mepiquat chloride24307-26-438 % similar Dimethyldioctadecylammonium chloride107-64-231 % similar Octyldecyldimethylammonium chloride32426-11-231 % similar Dilauryldimethylammonium chloride3401-74-931 % similar Dioctyldimethylammonium chloride5538-94-331 % similar Didecyldimethylammonium chloride7173-51-531 % similar

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

Same formula

Polydadmac26062-79-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook