3-cyano-2,4-difluorobenzoic acid

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3-cyano-2,4-difluorobenzoic acid Basic information
Product Name:3-cyano-2,4-difluorobenzoic acid
Synonyms:3-cyano-2,4-difluorobenzoic acid;Benzoic acid, 3-cyano-2,4-difluoro-
CAS:177942-39-1
MF:C8H3F2NO2
MW:183.11
EINECS:
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Mol File:177942-39-1.mol
3-cyano-2,4-difluorobenzoic acid Structure
3-cyano-2,4-difluorobenzoic acid Chemical Properties
Boiling point 303.0±42.0 °C(Predicted)
density 1.51±0.1 g/cm3(Predicted)
pka2.65±0.10(Predicted)
Safety Information
MSDS Information
3-cyano-2,4-difluorobenzoic acid Usage And Synthesis
SynthesisTo a 1 L reaction vial were sequentially added 49.9 g (0.36 mol) of 2,4-difluoro-3-carboxamide benzoic acid, 31.6 g (0.40 mol) pyridine, and 376 g tetrahydrofuran (THF). Place in a low temperature bath to cool down to -5 , dropwise addition of 83.2g (0.396mol) trifluoroacetic anhydride (TFAA), about 1h dropwise. The reaction was held at -5~5 for 1 h, then warmed up to 30 and held for 3 h. At the end of the reaction, desolventized to remove THF, added 100 g of water and 180 g of ethyl acetate, partitioned, washed with water, collected the organic phase, and removed the ethyl acetate to obtain 3-cyano-2,4-difluorobenzoic acid.
3-cyano-2,4-difluorobenzoic acid Preparation Products And Raw materials
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