Hexane → 3-Bromo-5-(4-chlorophenyl)-2-ethyl-thiophene

HRID 41674

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HRID 41674 반응식
[Br:1][C:2]1[CH:6]=[C:5](Br)[S:4][C:3]=1[CH2:8][CH3:9].C([Li])CCC.CCCCCC.B(OC)(OC)OC.C1(P(C2C=CC=CC=2)C2C=CC=CC=2)C=CC=CC=1.[Cl:47][C:48]1[CH:53]=[CH:52][C:51](I)=[CH:50][CH:49]=1.C(=O)([O-])[O-].[Na+].[Na+]>C(OCC)C.C([O-])(=O)C.[Pd+2].C([O-])(=O)C.C1COCC1>[Br:1][C:2]1[CH:6]=[C:5]([C:51]2[CH:52]=[CH:53][C:48]([Cl:47])=[CH:49][CH:50]=2)[S:4][C:3]=1[CH2:8][CH3:9]

참가 물질

11

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온도
-78 °C

실험 절차

To a solution of 3,5-dibromo-2-ethyl-thiophene (3.28 g, 12.15 mmol) in diethyl ether (50 ml) at −78° C. under N2 is added, slowly, 2.5M butyl lithium in hexane solution (4.86 ml, 12.15 mmol) over 10 minutes and the reaction stirred at −78° C. for a further 30 minutes. The reaction is then cooled to −78° C. before the dropwise addition of trimethyl borate (1.64 ml, 14.6 mmol) over 5 minutes. The reaction is stirred at −78° C. for 30 minutes, then allowed to warm to room temperature and stirred for a further 60 minutes. Palladium acetate (68 mg, 0.3 mmol), triphenylphosphine (314 mg, 1.2 mmol) and 4-chloro-iodobenzene (4.9 g, 12.15 mmol) is then added to the reaction, followed by THF (50 ml) and 1N sodium carbonate solution (20 ml) and the reaction is heated to reflux for 3 hours. The cooled reaction mixture is partitioned between ether (250 ml) and water (300 ml). The organic layer is separated, dried over magnesium sulphate, filtered and evaporated under reduced pressure. The residue is therefore purified by flash chromatography on silica gel to give 3-bromo-5-(4-chlorophenyl)-2-ethyl-thiophene as a white solid (2.75 g).

후처리

  1. stirringThe reaction is stirred at −78° C. for 30 minutes
  2. temperatureto warm to room temperature
  3. stirringstirred for a further 60 minutes
  4. temperaturethe reaction is heated
  5. temperatureto reflux for 3 hours
  6. customThe cooled reaction mixture
  7. customis partitioned between ether (250 ml) and water (300 ml)
  8. customThe organic layer is separated
  9. dry with materialdried over magnesium sulphate
  10. filtrationfiltered
  11. customevaporated under reduced pressure
  12. customThe residue is therefore purified by flash chromatography on silica gel

출처 및 근거

ORD 기록
ord-f69b0b8d89b34c5cb08116bccd469b1f
출처 데이터셋
uspto-grants-2013_09
특허 번호
US08530667B2

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