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Key Documents

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

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.
  • To produce aqueous biphasic system for the heavy metal ions preconcentration.
  • As a phase transfer salt to fabricate an optical chemical gas-sensor.

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

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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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
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