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Chemical Structure| 77422-70-9 Chemical Structure| 77422-70-9

Structure of 77422-70-9

Chemical Structure| 77422-70-9

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Product Details of [ 77422-70-9 ]

CAS No. :77422-70-9
Formula : C14H12N6S
M.W : 296.35
SMILES Code : [N-]=[N+]=NCC1=CC=CC=C1SC2=CC=CC=C2CN=[N+]=[N-]
MDL No. :MFCD00009700

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Application In Synthesis of [ 77422-70-9 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Downstream synthetic route of [ 77422-70-9 ]

[ 77422-70-9 ] Synthesis Path-Downstream   1~3

  • 1
  • [ 77422-70-9 ]
  • [ 65854-91-3 ]
  • [ 77422-76-5 ]
  • 2
  • [ 326-62-5 ]
  • [ 77422-70-9 ]
  • [ 252369-25-8 ]
  • 3
  • [ 326-62-5 ]
  • [ 77422-70-9 ]
  • 5-(2-fluorophenyl)-3-phenylsulfenylmethyl-3H-1,2,3-triazol-4-ylamine [ No CAS ]
YieldReaction ConditionsOperation in experiment
29% With potassium carbonate; In dimethyl sulfoxide; for 16h; To a stirred suspension of potassium carbonate (19.5 g, 141 mmol) in dry dimethylsulfoxide (100 ml) under nitrogen was added 2-fluorophenylacetonitrile (5.9 ml, 46 mmol).. The reaction was stirred for 5 minutes at which time azidomethyl phenyl sulfide (5 ml, 35.3 mmol) was added dropwise.. The resulting yellow reaction mixture was stirred at room temperature for 16 hours before slow addition to distilled water (2000 ml) with vigorous stirring.. The aqueous mixture was extracted with ethyl acetate (4*500 ml) and the combined organic extracts were washed with brine (500 ml), dried (Na2SO4) and the solvent removed in vacuo.. The resultant brown oil was purified by flash chromatography (25% EtOAc/isohexane) and the product crystallized from diethyl ether to furnish 5-(2-fluorophenyl)-3-phenylsulfenylmethyl-3H-1,2,3-triazol-4-ylamine (3.04 g, 29%) as a pale yellow solid. deltaH (400 MHz, CDCl3) 4.10 (2H, br s, NH2), 5.55 (2H, s, PhSCH2), 7.11 (1H, ddd, J=11.5, 8.2 and 1, ArH), 7.22-7.32 (5H, m, ArH), 7.39-7.41 (2 H, m, ArH), 7.89 (1H, td, J=7.5 and 2.0, ArH); m/z (ES+) 301 (M+H+).
 

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