71682-95-6 Usage
Description
3-(2',4'-DIFLUOROPHENYL)-3-OXOPROPANENITRILE is an organic compound that serves as a key intermediate in the synthesis of various pharmaceutical compounds. It is characterized by its unique structure, which includes a difluorophenyl group and a nitrile group, making it a versatile building block for the development of new drugs and chemical entities.
Uses
Used in Pharmaceutical Industry:
3-(2',4'-DIFLUOROPHENYL)-3-OXOPROPANENITRILE is used as a reagent for the synthesis of benzoylnacetonitriles, which are compounds with potential antiarthritic effects. These benzoylnacetonitriles can be further modified and optimized to develop new drugs for the treatment of arthritis and related inflammatory conditions.
Additionally, due to its reactive functional groups, 3-(2',4'-DIFLUOROPHENYL)-3-OXOPROPANENITRILE can be employed in the synthesis of other bioactive molecules, expanding its applications in the pharmaceutical industry. Its unique structure and reactivity make it a valuable tool for medicinal chemists in their pursuit of discovering new therapeutic agents.
Check Digit Verification of cas no
The CAS Registry Mumber 71682-95-6 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 7,1,6,8 and 2 respectively; the second part has 2 digits, 9 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 71682-95:
(7*7)+(6*1)+(5*6)+(4*8)+(3*2)+(2*9)+(1*5)=146
146 % 10 = 6
So 71682-95-6 is a valid CAS Registry Number.
InChI:InChI=1/C9H5F2NO/c10-6-1-2-7(8(11)5-6)9(13)3-4-12/h1-2,5H,3H2
71682-95-6Relevant articles and documents
Phase transfer catalyst in grindstone synthesis of 3-oxopropanenitrile: One pot synthesis of polysubstituted amino thiophenes
Patil, Shivaraj P.,Kanawade, Shrikant B.,Shinde, Madhukar P.,Toche, Raghunath B.
, p. 33 - 36 (2013/09/24)
The chemoselective SN2 reaction of ω-bromoacetophenone with sodium cyanide or potassium cyanide in DMF-water or in biphasic solvent toluene-water using tetrabutylammonium bromide (TBAB) as phase-transfer catalyst, performed by grinding, furnished 3-oxopropanenitriles 2 as the sole product in 70-80% yield, while in ethanolwater, mixture of compound 2 and oxirane 3 were obtained. The obtained 3-oxopropanenitriles 2 were used for one pot synthesis of 2-amino-3-carbonitrile thiophenes.
Potential antiarthritic agents. II. Benzoylacetonitriles and β-aminocinnamonitriles
Ridge,Hanifin,Harten,Johnson,Menschik,Nicolau,Sloboda,Watts
, p. 1385 - 1389 (2007/10/09)
Benzoylacetonitrile and β-aminocinnamonitrile are shown to possess potent intiinflammatory activity in the rat adjuvant arthritis model. In a series of phenyl-substituted analogues, only o-, m-, and p-fluorobenzoylacetonitrile and m- and p-fluoro-β-aminocinnamonitrile retained activity. Additionally, β-amino-2- and β-amino-3-thiopheneacrylonitrile and β-oxo-2- and β-oxo-3-thiophenepropionitrile exhibited similar activity. These agents are not believed to be acting via prostaglandin synthetase inhibition. The metabolic profile of benzoylacetonitrile is also described.
