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Cesium carbonate → HCID 86707274, 화합물

HRID 576066
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HRID 576066 반응식
Br[C:2]1[CH:8]=[CH:7][C:5]([NH2:6])=[C:4]([F:9])[CH:3]=1.[CH:10]1([CH2:15]/[CH:16]=[CH:17]/B2OC(C)(C)C(C)(C)O2)[CH2:14][CH2:13][CH2:12][CH2:11]1.O1C=CC=C1P(C1OC=CC=1)C1OC=CC=1.C(=O)([O-])[O-].[Cs+].[Cs+]>C(OCC)(=O)C.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].O.O1CCOCC1>[CH:10]1([CH2:15]/[CH:16]=[CH:17]/[C:2]2[CH:8]=[CH:7][C:5]([NH2:6])=[C:4]([F:9])[CH:3]=2)[CH2:14][CH2:13][CH2:12][CH2:11]1
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참가 물질

9

반응물 4

HCID 10796Cesium carbonateHCID 1230504-Bromo-2-fluoroanilineHCID 521585Tris(furan-2-yl)phosphaneHCID 162181952-[(1E)-3-Cyclopentylprop-1-en-1-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

생성물 1

HCID 86707274HCID 86707274, 화합물수율 91.8%

시약·촉매·용매 4

HCID 9811564
Bis(dibenzylideneacetone)palladium
촉매
HCID 962Water용매
HCID 8857Ethyl Acetate용매
HCID 312751,4-Dioxane용매

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온도
100 °C

실험 절차

1,4-Dioxane (5 mL) and water (1.2 mL) were added to 4-bromo-2-fluoroaniline (285 mg, 1.50 mmol), trans-3-(cyclopentyl)propenylboronic acid pinacol ester (425 mg, 1.80 mmol), tris(dibenzylidene acetone)dipalladium (137 mg, 0.15 mmol), tri-2-furylphosphine (210 mg, 0.90 mmol) and cesium carbonate (976 mg, 3.00 mmol). The mixture was heated to an external temperature of 100° C. and stirred for 6 hr, under a nitrogen atmosphere. After cooling, the mixture was diluted with ethyl acetate and washed with brine. The organic layer was dried over anhydrous magnesium sulfate and then the desiccant was filtered off, followed by concentration under reduced pressure. The resulting residue was purified by silica gel column chromatography (hexane only→hexane:ethyl acetate=9:1) to afford the title compound as a pale yellow oil (302 mg).

후처리

  1. temperatureAfter cooling
  2. washwashed with brine
  3. dry with materialThe organic layer was dried over anhydrous magnesium sulfate
  4. filtrationthe desiccant was filtered off
  5. concentrationfollowed by concentration under reduced pressure
  6. customThe resulting residue was purified by silica gel column chromatography (hexane only→hexane

출처 및 근거

ORD 기록
ord-97911015bf3c4f2e969f69206e1790ad
출처 데이터셋
uspto-grants-2015_05
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US09035059B2

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