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Hydrochloric Acid → HCID 57615034, 화합물

HRID 553204
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반응식

HRID 553204 반응식
C(P(C(C)(C)C)C(C)(C)C)(C)(C)C.CCCCCC.C(=O)([O-])[O-].[Cs+].[Cs+].Br[C:27]1[CH:28]=[CH:29][C:30]2[S:34][CH:33]=[CH:32][C:31]=2[CH:35]=1.[C:36]([O:44][CH2:45][CH3:46])(=[O:43])[CH2:37][C:38]([O:40][CH2:41][CH3:42])=[O:39].Cl>C1C=CC(/C=C/C(/C=C/C2C=CC=CC=2)=O)=CC=1.C1C=CC(/C=C/C(/C=C/C2C=CC=CC=2)=O)=CC=1.C1C=CC(/C=C/C(/C=C/C2C=CC=CC=2)=O)=CC=1.[Pd].[Pd].C(OCC)(=O)C.O.COCCOC>[S:34]1[C:30]2[CH:29]=[CH:28][C:27]([CH:37]([C:38]([O:40][CH2:41][CH3:42])=[O:39])[C:36]([O:44][CH2:45][CH3:46])=[O:43])=[CH:35][C:31]=2[CH:32]=[CH:33]1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

10

반응물 5

HCID 313Hydrochloric AcidHCID 7761Diethyl MalonateHCID 10796Cesium carbonateHCID 27765785-Bromo-1-benzothiopheneHCID 86628723Tri(tert-butyl)phosphine hexane

생성물 1

HCID 57615034HCID 57615034, 화합물수율 100.6%

시약·촉매·용매 4

HCID 9811564Bis(dibenzylideneacetone)palladium촉매
HCID 962Water용매
HCID 80711,2-Dimethoxyethane용매
HCID 8857Ethyl Acetate용매

실험 절차

To 1,2-dimethoxyethane (10 mL) suspension of 0.02 g of tris(dibenzylideneacetone)dipalladium(0) were added 0.11 g of 10% (w/w) tri(tert-butyl)phosphine/hexane, 1.76 g of cesium carbonate, 0.50 g of 5-bromobenzothiophene and 0.45 g of diethyl malonate, which was then refluxed for 2 hours. To the reaction mixture were added water and ethyl acetate, followed by adjustment to pH2 using 2 mol/L hydrochloric acid. The organic layer was separated, and dried over anhydrous magnesium sulfate, followed by distilling off the solvent under reduced pressure. The resultant residue was purified using silica gel column chromatography (eluent; hexane:ethyl acetate=10:1) to provide 0.69 g of diethyl 2-(1-benzothiophen-5-yl)malonate as white solid form.

후처리

  1. temperaturewas then refluxed for 2 hours
  2. customThe organic layer was separated
  3. dry with materialdried over anhydrous magnesium sulfate
  4. distillationby distilling off the solvent under reduced pressure
  5. customThe resultant residue was purified

출처 및 근거

ORD 기록
ord-cdfdf06052fc4447b28a3c35d6f56267
출처 데이터셋
uspto-grants-2011_05
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US07951963B2

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