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Methyl vinyl ketone → 4-(3-Chloropyridin-2-yl)-4-methylcyclohex-2-enone

HRID 661376
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HRID 661376 반응식
[Cl:1][C:2]1[C:3]([CH:8]([CH3:11])[CH:9]=O)=[N:4][CH:5]=[CH:6][CH:7]=1.[OH-].[K+].[CH:14]([C:16]([CH3:18])=[O:17])=[CH2:15]>C(OCC)C>[Cl:1][C:2]1[C:3]([C:8]2([CH3:11])[CH2:15][CH2:14][C:16](=[O:17])[CH:18]=[CH:9]2)=[N:4][CH:5]=[CH:6][CH:7]=1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

5

반응물 3

HCID 6570Methyl vinyl ketoneHCID 14797Potassium HydroxideHCID 866302832-(3-Chloropyridin-2-yl)propanal

생성물 1

HCID 674999494-(3-Chloropyridin-2-yl)-4-methylcyclohex-2-enone수율 22%

시약·촉매·용매 1

HCID 3283Diethyl Ether용매2회

실험 절차

To a 0° C. solution of the product of Example 38D (0.71 g, 4.19 mmol) in diethyl ether (10 mL) was added a solution of potassium hydroxide (3M in methanol, 0.56 mL, 1.68 mmol), followed by methyl vinyl ketone (0.47 g, 0.55 mL, 6.70 mmol). The reaction was allowed to warm to ambient temperature and stirred overnight. The reaction mixture was diluted with diethyl ether, and washed with water and brine. The organic layer was concentrated, and the residue was chromatographed on silica gel eluting with 25% ethyl acetate-hexane to give the title compound (0.20 g, 22%). 1H NMR (300 MHz, DMSO-d6) δ ppm 8.53 (dd, J=1.5, 4.6, 1H), 7.92 (dd, J=1.5, 8.0, 1H), 7.45-7.26 (m, 2H), 5.92 (d, J=10.2, 1H), 2.82-2.67 (m, 1H), 2.64-2.52 (m, 1H), 2.31 (ddd, J=4.8, 7.2, 17.3, 1H), 2.12-2.00 (m, 1H). MS (DCI) m/z 222 (M+H)+.

후처리

  1. washwashed with water and brine
  2. concentrationThe organic layer was concentrated
  3. customthe residue was chromatographed on silica gel eluting with 25% ethyl acetate-hexane

출처 및 근거

ORD 기록
ord-671b2026bdc7401dba48c375eba86d9e
출처 데이터셋
uspto-grants-2011_12
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08084616B2

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