chempirical

Diethylammonium chloride

C4H12ClNCAS 660-68-4109.60 g/mol

Open in Covalent MOL file
NHHCl
Secondary amine

Properties

Molecular formula
C4H12ClN
Molar mass
109.60 g/mol
Exact mass
109.0658 Da
Melting point
228.5 °C
logP
1.04Crippen estimate
Polar surface area
12.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Identifiers

CAS number
660-68-4
SMILES
CCNCC.Cl
InChIKey
HDITUCONWLWUJR-UHFFFAOYSA-N
InChI
InChI=1S/C4H11N.ClH/c1-3-5-4-2;/h5H,3-4H2,1-2H3;1H

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

Names and synonyms

6 names
  • Ethanamine, N-ethyl-, hydrochloride (1:1)
  • Diethylamine, hydrochloride
  • Ethanamine, N-ethyl-, hydrochloride
  • N-Ethylethanamine hydrochloride
  • Diethylamine hydrochloride
  • N,N-Diethylamine hydrochloride

Work with Diethylammonium 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

Diethylamine109-89-775 % similar Titanium tetrakis(diethylamine)4419-47-060 % similar Diethylammonium bromide6274-12-060 % similar N,N′-Diethylethylenediamine111-74-053 % similar N-Methylethylamine hydrochloride624-60-253 % similar N1,N3-Diethyl-1,3-propanediamine10061-68-447 % similar Ethylpropylamine20193-20-844 % similar Ethylamine hydrochloride557-66-441 % similar

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

Same formula

n-Butylammonium chloride3858-78-4 Tetramethylammonium chloride75-57-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook