chempirical

Diethylammonium bromide

C4H12BrNCAS 6274-12-0154.05 g/mol

Open in Covalent MOL file
HBrNH
Secondary amine

Properties

Molecular formula
C4H12BrN
Molar mass
154.05 g/mol
Exact mass
153.0153 Da
Melting point
218–220 °C
logP
1.19Crippen estimate
Polar surface area
12.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Identifiers

CAS number
6274-12-0
SMILES
Br.CCNCC
InChIKey
AATGHKSFEUVOPF-UHFFFAOYSA-N
InChI
InChI=1S/C4H11N.BrH/c1-3-5-4-2;/h5H,3-4H2,1-2H3;1H

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Names and synonyms

3 names
  • Ethanamine, N-ethyl-, hydrobromide (1:1)
  • Diethylamine, hydrobromide
  • Ethanamine, N-ethyl-, hydrobromide

Work with Diethylammonium bromide

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 chloride660-68-460 % similar N,N′-Diethylethylenediamine111-74-053 % similar N1,N3-Diethyl-1,3-propanediamine10061-68-447 % similar Ethylpropylamine20193-20-844 % similar Ethylamine monohydrobromide593-55-541 % similar N-Ethylethylenediamine110-72-540 % similar

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

Same formula

Tetramethylammonium bromide64-20-0

Elsewhere

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