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2-(tert-butyldimethylsilyloxy)-N-methoxy-N-methylacetamide → 2-(Tert-butyldimethylsilyloxy)-1-(3-chloro-4-fluorophenyl)ethanone

HRID 2365797
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HRID 2365797 반응식
[Cl:1][C:2]1[CH:3]=[C:4]([Mg]Br)[CH:5]=[CH:6][C:7]=1[F:8].[Si:11]([O:18][CH2:19][C:20](N(OC)C)=[O:21])([C:14]([CH3:17])([CH3:16])[CH3:15])([CH3:13])[CH3:12]>C1COCC1.CCCCCC>[Si:11]([O:18][CH2:19][C:20]([C:4]1[CH:5]=[CH:6][C:7]([F:8])=[C:2]([Cl:1])[CH:3]=1)=[O:21])([C:14]([CH3:17])([CH3:16])[CH3:15])([CH3:13])[CH3:12]
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

5

반응물 2

HCID 116010942-(tert-butyldimethylsilyloxy)-N-methoxy-N-methylacetamideHCID 178505834HCID 178505834, 화합물

생성물 1

HCID 866966542-(Tert-butyldimethylsilyloxy)-1-(3-chloro-4-fluorophenyl)ethanone수율 87.9%

시약·촉매·용매 2

HCID 8028Tetrahydrofuran용매2회HCID 8058Hexane용매

실험 절차

0.5M (3-Chloro-4-fluorophenyl)magnesium bromide in THF (27.4 mL, 13.7 mmol) was added dropwise to 2-(tert-butyldimethylsilyloxy)-N-methoxy-N-methylacetamide (2.00 g, 8.57 mmol) in THF (20 mL) cooled in ice. The mixture became turbid after about half of the Grignard reagent was added. This was stirred in an ice bath for 2 hours, quenched with saturated aqueous NH4Cl, and concentrated to remove the THF. The aqueous residue was extracted with 2 portions DCM. The combined DCM layers were dried over MgSO4, filtered, and evaporated to yield a crude product (3.62 g) as an oil. This was taken up in hexane and purified on a silica gel plug with hexane until product started eluting, then 15:1 hexane/EtOAc. Product-containing fractions yielded 2-(tert-butyldimethylsilyloxy)-1-(3-chloro-4-fluorophenyl)ethanone (2.28 g, 7.53 mmol, 87.9% yield) as an oil.

후처리

  1. temperaturecooled in ice
  2. additionwas added
  3. customquenched with saturated aqueous NH4Cl
  4. concentrationconcentrated
  5. customto remove the THF
  6. extractionThe aqueous residue was extracted with 2 portions DCM
  7. dry with materialThe combined DCM layers were dried over MgSO4
  8. filtrationfiltered
  9. customevaporated
  10. customto yield a crude product (3.62 g) as an oil
  11. custompurified on a silica gel plug with hexane until product
  12. washstarted eluting

출처 및 근거

ORD 기록
ord-464db169d43441809c32f0e33bc822d7
출처 데이터셋
uspto-grants-2014_04
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08697715B2

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