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Propionitrile → HCID 12026700, 화합물

HRID 1695222
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인쇄 미리보기

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HRID 1695222 반응식
[NH2:1][C:2]1[CH:6]=[CH:5]NN=1.COC(=O)C1C=CC(OCC2CC2)=C(Cl)C=1.[CH3:23][C:24]1[CH:33]=[CH:32][CH:31]=[CH:30][C:25]=1[C:26]([O:28]C)=O.[H-].[Na+].C(#N)CC>C1(C)C=CC=CC=1.O>[CH3:5][CH:6]([C:26](=[O:28])[C:25]1[CH:30]=[CH:31][CH:32]=[CH:33][C:24]=1[CH3:23])[C:2]#[N:1]
참가 물질반응 조건실험 절차후처리출처 및 근거반응 노트

참가 물질

8

반응물 5

HCID 7854PropionitrileHCID 24758Sodium hydrideHCID 33094Methyl o-toluateHCID 67015924HCID 67015924, 화합물HCID 178418806HCID 178418806, 화합물

생성물 1

HCID 12026700HCID 12026700, 화합물수율 88%

시약·촉매·용매 2

HCID 962
Water
용매
HCID 1140Toluene용매

반응 조건

온도
80 °C

실험 절차

The product was prepared according to the general procedure for aminopyrazole synthesis (route A1). The mixture of methyl 2-methylbenzoate (3.0 mL, 20.0 mmol, 1.0 eq) and NaH (1.6 g, 40.0 mmol, 2.0 eq) in dry toluene (20 mL) was heated at 80° C. and then propionitrile (6.7 mL, 94.4 mmol. 4.7 eq) was added dropwise; the reaction was heated for 18 hours. The crude product was dissolved in water and extracted with DCM, and it was used in the following step without further purification (3.04 g, yield: 88%).

후처리

  1. customThe product was prepared
  2. temperaturethe reaction was heated for 18 hours
  3. extractionextracted with DCM, and it
  4. customwas used in the following step without further purification (3.04 g, yield: 88%)

출처 및 근거

ORD 기록
ord-372504a95b524c67974d814a43afbba8
출처 데이터셋
uspto-grants-2012_04
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08163729B2

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