1,1,1-Trifluoro-2-iodoethane → 4-Iodo-1-(2,2,2-trifluoroethyl)-1H-pyrazole

HRID 646226Notes

Reaction equation

HRID 646226 reaction equation
[I:1][C:2]1[CH:3]=[N:4][NH:5][CH:6]=1.[F:7][C:8]([F:12])([F:11])[CH2:9]I>CN(C=O)C>[I:1][C:2]1[CH:3]=[N:4][N:5]([CH2:9][C:8]([F:12])([F:11])[F:7])[CH:6]=1

Participants

4

Conditions

Temperature
60 °C

Procedure

A mixture of 4-iodo-1H-pyrazole (960 mg, 5 mmol), 2,2,2-trifluoroethyl iodide (3.13 g, 15 mmol) and CS2CO3 (2.4 g, 7.7 mmol) in DMF (5 ml) is heated at 60° C. with stirring overnight. After cooling, the reaction mixture is partitioned between water (50 ml) and ether (20 ml). The organic layer is separated, dried (MgSO4) and concentrated to afford the title compound as an oil which solidified upon standing 1.0 g (72%). 1HNMR (CDCl3): δ (ppm) 4.70 (m, 2H), 7.56 (s, 1H), 7.59 (s, 1H).

Workup

  1. temperatureAfter cooling
  2. customthe reaction mixture is partitioned between water (50 ml) and ether (20 ml)
  3. customThe organic layer is separated
  4. dry with materialdried (MgSO4)
  5. concentrationconcentrated

Sources & evidence

ORD record
ord-12ed34ecab0740fe9a80eddc787edeb3
Source dataset
uspto-grants-2010_04
Patent number
US07705030B2

Reaction notes

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