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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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1-Bromo-2-fluorobenzene → 5-(2-Fluorophenyl)-1-methylimidazole-4-carbonitrile

HRID 1933453
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HRID 1933453 반응식
Cn1cnc(C#N)c1.Fc1ccccc1Br>C=C[CH2-].C=C[CH2-].CC(=O)[O-].CCCC#N.C[C@]12C[C@@]3(C)O[C@](C)(C[C@@](C)(O1)P3c1ccccc1)O2.[Cl][Pd+].[Cl][Pd+].[Cs+]>Cn1cnc(C#N)c1-c1ccccc1F
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참가 물질

9

반응물 2

HCID 612591-Bromo-2-fluorobenzeneHCID 27951151-Methyl-1H-imidazole-4-carbonitrile

생성물 2

HCID 741954,4'-Bis(1,1-dimethylethyl)-1,1'-biphenylHCID 841174465-(2-Fluorophenyl)-1-methylimidazole-4-carbonitrile수율 57.95%

시약·촉매·용매 5

HCID 5152919Cesium acetate시약HCID 61538Palladium, di-mu-chlorobis(eta3-2-propenyl)di-촉매HCID 71669129HCID 71669129, 화합물촉매HCID 8008Butyronitrile용매HCID 741954,4'-Bis(1,1-dimethylethyl)-1,1'-biphenyl내부 표준

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온도
90 °C

후처리

  1. additionThe plate was removed from the glovebox, opened, and diluted to a 900 uL total volume with N,N-dimethylacetamide. The plate was stirred for 5 min and a 75 uL sample was taken and filtered into an HPLC analysis plate. The filter was rinsed with 400 uL acetonitrile/water (4:1) solution and analyzed by UHPLCMS
  2. stirring기록된 절차가 없습니다
  3. aliquot기록된 절차가 없습니다
  4. filtrationorganic 상 유지

출처 및 근거

ORD 기록
ord-1fc871d7c4d642cab39c63fafd81d4d9
출처 데이터셋
Shields Arylation

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