chempirical

N-(2-Chloroethyl)dibenzylamine hydrochloride

C16H19Cl2NCAS 55-43-6296.24 g/mol

Open in Covalent MOL file
HClClN
Alkyl halideTertiary amine

Properties

Molecular formula
C16H19Cl2N
Molar mass
296.24 g/mol
Exact mass
295.0895 Da
Melting point
192 °C
logP
4.35Crippen estimate
Polar surface area
3.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
6

Identifiers

CAS number
55-43-6
SMILES
Cl.ClCCN(Cc1ccccc1)Cc1ccccc1
InChIKey
LZXCEBPGNFLHEQ-UHFFFAOYSA-N
InChI
InChI=1S/C16H18ClN.ClH/c17-11-12-18(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16;/h1-10H,11-14H2;1H

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

Names and synonyms

11 names
  • Benzenemethanamine, N-(2-chloroethyl)-N-(phenylmethyl)-, hydrochloride (1:1)
  • Dibenzylamine, N-(2-chloroethyl)-, hydrochloride
  • Benzenemethanamine, N-(2-chloroethyl)-N-(phenylmethyl)-, hydrochloride
  • Dibenamine hydrochloride
  • (N,N-Dibenzylamino)ethyl chloride hydrochloride
  • N,N-Dibenzyl-β-chloroethylamine hydrochloride
  • (β-Chloroethyl)dibenzylamine hydrochloride
  • Sympatholytin
  • 2-(Dibenzylamino)ethyl chloride hydrochloride
  • (2-Chloroethyl)dibenzylamine hydrochloride
  • N,N-Dibenzyl-2-chloroethanamine hydrochloride

Work with N-(2-Chloroethyl)dibenzylamine hydrochloride

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

N-Benzylbis(2-chloroethyl)amine hydrochloride10429-82-092 % similar 4-Benzylpiperazine hydrochloride110475-31-556 % similar Benzylpiperazine dihydrochloride5321-63-156 % similar 1,4,7,10-Tetrabenzyl-1,4,7,10-tetraazacyclododecane18084-64-556 % similar 1-Methyl-4-(phenylmethyl)piperazine hydrochloride (1:1)374898-00-755 % similar Tribenzylamine620-40-654 % similar 2-[Bis(phenylmethyl)amino]ethanol101-06-452 % similar 4-Amino-1-benzylpiperidine dihydrochloride1205-72-751 % similar

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

Elsewhere

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