Triethylammonium bromide

C6H16BrNCAS 636-70-4182.10 g/mol

Open in Covalent MOL file
HBrN
Tertiary amine

Properties

Molecular formula
C6H16BrN
Molar mass
182.10 g/mol
Exact mass
181.0466 Da
Melting point
246 °C
logP
1.93Crippen estimate
Polar surface area
3.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

Aggregated from 95 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
636-70-4
SMILES
Br.CCN(CC)CC
InChIKey
NRTLTGGGUQIRRT-UHFFFAOYSA-N
InChI
InChI=1S/C6H15N.BrH/c1-4-7(5-2)6-3;/h4-6H2,1-3H3;1H

Weigh it out

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

Names and synonyms

3 names
  • Ethanamine, N,N-diethyl-, hydrobromide (1:1)
  • Triethylamine, hydrobromide
  • Ethanamine, N,N-diethyl-, hydrobromide

Work with Triethylammonium 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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Triethylamine121-44-8Free base Triethylamine monohydrochloride554-68-7Salt N,N-Diethylethanamine trihydrofluoride73602-61-6Salt

Similar compounds

N,N,N′,N′-Tetraethylethylenediamine150-77-653 % similar 1,4-Diethylpiperazine6483-50-753 % similar 1-Ethylpyrrolidine7335-06-047 % similar N-Ethylpiperidine766-09-644 % similar Diethylaminoethyl chloride100-35-640 % similar N,N-Diethylethylenediamine100-36-740 % similar Diethylethanolamine100-37-840 % similar 2-(Diethylamino)ethanethiol100-38-940 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Trimethylpropylammonium bromide2650-50-2

Elsewhere

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