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Merck
CN

323659

1-Fluoropyridinium triflate

99%

Synonym(s):

1-Fluoropyridinium trifluoromethanesulfonate

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About This Item

Empirical Formula (Hill Notation):
C6H5F4NO3S
CAS Number:
Molecular Weight:
247.17
Beilstein/REAXYS Number:
4222821
UNSPSC Code:
12352101
NACRES:
NA.22
PubChem Substance ID:
MDL number:
Assay:
99%
Form:
solid
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Quality Segment

assay

99%

form

solid

mp

185-186 °C (lit.)

functional group

fluoro, triflate

SMILES string

F[n+]1ccccc1.[O-]S(=O)(=O)C(F)(F)F

InChI

1S/C5H5FN.CHF3O3S/c6-7-4-2-1-3-5-7;2-1(3,4)8(5,6)7/h1-5H;(H,5,6,7)/q+1;/p-1

InChI key

JFZMMCYRTJBQQI-UHFFFAOYSA-M

Application

General purpose electrophilic fluorinating reagent.
Reactant for:
  • Pd-catalyzed arylation reactions
  • Preparation of small molecule botulinum neurotoxin A endopeptidase inhibitors
  • Fluorination agent


pictograms

Corrosion

signalword

Danger

hcodes

Hazard Classifications

Eye Dam. 1 - Skin Corr. 1A

Storage Class

8A - Combustible corrosive hazardous materials

wgk

WGK 3

ppe

Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges



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