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Ethyl formate → 2-(2-Chloropyridin-3-yl)-3-oxopropanenitrile

HRID 593927
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HRID 593927 반응식
[Cl:1][C:2]1[C:7]([CH2:8][C:9]#[N:10])=[CH:6][CH:5]=[CH:4][N:3]=1.[H-].[Na+].[CH:13](OCC)=[O:14]>C1COCC1>[Cl:1][C:2]1[C:7]([CH:8]([CH:13]=[O:14])[C:9]#[N:10])=[CH:6][CH:5]=[CH:4][N:3]=1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

5

반응물 3

HCID 8025Ethyl formateHCID 24758Sodium hydrideHCID 147395432-(2-Chloropyridin-3-yl)acetonitrile

생성물 1

HCID 866141612-(2-Chloropyridin-3-yl)-3-oxopropanenitrile

시약·촉매·용매 1

HCID 8028Tetrahydrofuran용매2회

실험 절차

A solution of 2-(2-chloropyridin-3-yl)acetonitrile (2.0 g, 13 mmol) in THF (5 mL) was slowly added to a suspension of sodium hydride, 60% in mineral oil (1.31 g, 33.0 mmol) in THF (10 mL) at 0° C. The mixture was stirred for 15 minutes, and ethyl formate (1.1 mL, 13 mmol) was slowly added. The mixture was stirred at RT, and monitored by LCMS. Upon completion, the reaction was extracted into EtOAc, washed organics 2×H2O, dried with Mg2SO4, filtered through fritted funnel, and lyophilized to yield 2-(2-chloropyridin-3-yl)-3-oxopropanenitrile as reddish brown solid. The crude was used without further purification. MS m/z=181 [M+1]+. Calc'd for C8H5ClN2O: 180.59.

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후처리

  1. stirringThe mixture was stirred at RT
  2. extractionUpon completion, the reaction was extracted into EtOAc
  3. washwashed organics 2×H2O
  4. dry with materialdried with Mg2SO4
  5. filtrationfiltered through fritted funnel

출처 및 근거

ORD 기록
ord-fae8fd84bd3d467a8fc8af4eb222ba8a
출처 데이터셋
uspto-grants-2016_01
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US09242961B2

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