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Sigma-Aldrich

Barium trifluoromethanesulfonate

98%

Synonym(s):

Barium triflate, Trifluoromethanesulfonic acid barium salt

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About This Item

Linear Formula:
(CF3SO3)2Ba
CAS Number:
2794-60-7
Molecular Weight:
435.47
Beilstein:
3729346
EC Number:
220-526-6
MDL number:
MFCD00143644
UNSPSC Code:
12352302
PubChem Substance ID:
24866091
NACRES:
NA.22

Assay

98%

mp

>300 °C (lit.)

SMILES string

[Ba++].[O-]S(=O)(=O)C(F)(F)F.[O-]S(=O)(=O)C(F)(F)F

InChI

1S/2CHF3O3S.Ba/c2*2-1(3,4)8(5,6)7;/h2*(H,5,6,7);/q;;+2/p-2

InChI key

DXJURUJRANOYMX-UHFFFAOYSA-L

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Application

Ba(CF3SO3) can be utilized as a precursor to synthesize:
  • Alkali metal and silver trifluoromethanesulfonates.
  • Sodium trifluoromethanesulfonate (sodium triflate) by reacting with sodium sulfate. Sodium triflate finds application in organic synthesis as an efficient catalyst as well as a reactant in catalytic asymmetric Mannich-type reactions, and Diels-Alder reactions.

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H302 + H332

Hazard Classifications

Acute Tox. 4 Inhalation - Acute Tox. 4 Oral

Storage Class Code

11 - Combustible Solids

WGK

WGK 1

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

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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Sodium 1, 1, 1-Trifluoromethanesulfonate
Surya Prakash GK and Mathew T
Encyclopedia of Reagents for Organic Synthesis, Second Edition (2001)
Daniel Lundberg et al.
Physical chemistry chemical physics : PCCP, 20(21), 14525-14536 (2018-05-17)
The structures of the N,N-dimethylformamide (dmf), N,N-dimethylacetamide (dma), and N,N-dimethylpropionamide (dmp) solvated strontium and barium ions have been determined in solution using large angle X-ray scattering and EXAFS spectroscopy. The strontium ion has a mean coordination number (CN) between 6.2
Dominika Bratkowska et al.
Journal of separation science, 35(15), 1953-1958 (2012-08-07)
Two imidazolium supported ionic liquid phases (SILPs) containing different anions, trifluoromethanesulphonate [CF(3)SO(3)(-)], and tetrafluoroborate [BF(4)(-)], were synthesized and evaluated as solid-phase extraction sorbents for extracting acidic pharmaceuticals from aqueous samples under strong anion-exchange conditions, which include an effective cleanup of
Lingyong Jiang et al.
Organic & biomolecular chemistry, 10(40), 8102-8107 (2012-09-06)
A silver triflate-catalyzed tandem reaction of N'-(2-alkynylbenzylidene)hydrazide with pyridyne is presented. Different outcomes are obtained, depending on the pyridynes utilized in the transformation.
Atsushi Kinbara et al.
The Journal of organic chemistry, 77(20), 8999-9005 (2012-09-26)
A cationic rhodium(I) complex- or In(OTf)(3)-catalyzed synthesis of phenol derivatives from cyclohex-2-enone having an ethoxycarbonyl-substituted alkyne has been achieved. This reaction proceeds via enolization and an intramolecular Alder-Rickert reaction.
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