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419087

Barium trifluoromethanesulfonate

Name: Barium trifluoromethanesulfonate
Brand: ALDRICH

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

UNSPSC Code:

12352302

NACRES:

NA.22

PubChem Substance ID:

24866091

EC Number:

220-526-6

Beilstein/REAXYS Number:

3729346

MDL number:

MFCD00143644

Assay:

98%

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Properties

Quality Level

200

assay

98%

reaction suitability

core: barium

mp

>300 °C (lit.)

functional group

fluoro, triflate

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

Description

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

GHS07

signalword

Warning

hcodes

H302 + H332

pcodes

P261 - P264 - P271 - P301 + P312 - P304 + P340 + P312 - P501

Hazard Classifications

Acute Tox. 4 Inhalation - Acute Tox. 4 Oral

Storage Class

11 - Combustible Solids

flash_point_f

Not applicable

flash_point_c

Not applicable

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Certificates of Analysis (COA)

Lot/Batch Number

0000258586

0000158092

0000140607

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Sodium 1, 1, 1-Trifluoromethanesulfonate

Surya Prakash GK and Mathew T

Encyclopedia of Reagents for Organic Synthesis, Second Edition (2001)

On the relationship between the structural and volumetric properties of solvated metal ions in O-donor solvents using new structural data in amide solvents.

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

Cu(OTf)2-catalyzed synthesis of 2,3-disubstituted indoles and 2,4,5-trisubstituted pyrroles from α-diazoketones.

B V Subba Reddy et al.

Organic letters, 15(3), 464-467 (2013-01-18)

A novel method has been devised for the synthesis of 2,4,5-trisubstituted pyrrole derivatives through the coupling of α-diazoketones with β-enaminoketones and esters using 10 mol % of Cu(OTf)(2). A wide range of 2,3-disubstituted indole derivatives were also prepared from α-diazoketones

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Global Trade Item Number

SKU	GTIN
419087-5G	04061833323106