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Merck

252816

Sigma-Aldrich

Tetrahexylammonium bromide

99%

Synonym(s):

THABr

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About This Item

Linear Formula:
[CH3(CH2)5]4N(Br)
CAS Number:
Molecular Weight:
434.58
Beilstein:
3637302
EC Number:
MDL number:
UNSPSC Code:
12352116
PubChem Substance ID:
NACRES:
NA.22

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Quality Level

Assay

99%

form

solid

mp

99-100 °C (lit.)

SMILES string

[Br-].CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC

InChI

1S/C24H52N.BrH/c1-5-9-13-17-21-25(22-18-14-10-6-2,23-19-15-11-7-3)24-20-16-12-8-4;/h5-24H2,1-4H3;1H/q+1;/p-1

InChI key

SYZCZDCAEVUSPM-UHFFFAOYSA-M

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Application

Tetrahexylammonium bromide can be used:
  • As a hydrogen bond acceptor in the preparation of deep eutectic solvents which can be used for desulfurization and denitrogenation from n-heptane.[1]
  • To produce aqueous biphasic system for the heavy metal ions preconcentration.[2]
  • As a phase transfer salt to fabricate an optical chemical gas-sensor.[3]

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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O?Toole M, et al.
Analytica Chimica Acta, 652(1-2), 308-314 (2009)
Multielement Determination of Trace Heavy Metals in Water by Microwave-Induced Plasma Atomic Emission Spectrometry after Extraction in Unconventional Single-Salt Aqueous Biphasic System
Smirnova SV, et al.
Analytical Chemistry, 90(10), 6323-6331 (2018)
Extraction of benzothiazole and thiophene from their mixtures with n-heptane using tetrahexylammonium bromide-based deep eutectic solvents as extractive denitrogenation and desulfurization agents
Alli RD and Kroon MC
Fluid Phase Equilibria, 477, 1-11 (2018)
Zeynep S Teksin et al.
Journal of controlled release : official journal of the Controlled Release Society, 116(1), 50-57 (2006-10-20)
Parallel Artificial Membrane Permeability Assay (PAMPA) is a method to screen drug candidates for membrane permeability. The objective was to characterize the transport of a model weak base, metoprolol, across a three lipid-component PAMPA system (denoted A-PAMPA, for anionic-PAMPA) and
N Surendran et al.
Journal of chromatography. B, Biomedical sciences and applications, 691(2), 305-312 (1997-04-11)
The objective of this research was to develop a rapid, sensitive and reliable method for the separation of phosphonodipeptide prodrugs and parent compounds to facilitate the evaluation of cell permeation using in vitro cell culture models. Separation was accomplished isocratically

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