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4-Cyanobenzaldehyde → 4-[(1E,3E)-5-Oxo-1,3-pentadienyl]benzonitrile

HRID 1250385
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HRID 1250385 반응식
[CH:1]([C:3]1[CH:10]=[CH:9][C:6]([C:7]#[N:8])=[CH:5][CH:4]=1)=O.C1(P(=[CH:30]/[CH:31]=[CH:32]/[CH:33]=[O:34])(C2C=CC=CC=2)C2C=CC=CC=2)C=CC=CC=1>ClCCl>[O:34]=[CH:33]/[CH:32]=[CH:31]/[CH:30]=[CH:1]/[C:3]1[CH:10]=[CH:9][C:6]([C:7]#[N:8])=[CH:5][CH:4]=1
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참가 물질

4

반응물 2

HCID 660424-CyanobenzaldehydeHCID 10980420HCID 10980420, 화합물

생성물 1

HCID 106550534-[(1E,3E)-5-Oxo-1,3-pentadienyl]benzonitrile

시약·촉매·용매 1

HCID 6344Dichloromethane용매

실험 절차

A solution of 13.1 g (99 mmol) of 4-formylbenzonitrile (commercially available) and 40 g (120 mmol) of (triphenylphosphoranylidene)crotonaldehyde [prepared as described in Tetrahedron Lett., 493 (1971)] in 200 ml of dichloromethane was stirred at ambient temperature overnight. At the end of this time, the reaction mixture was concentrated to dryness in vacuo. The resulting residue was purified by chromatography on a silica gel (250 g) column using ethyl acetate as the eluant to give a mixture of the desired compound and a geometrical isomer thereof. A solution of the mixture of the two isomers in 150 ml of toluene was heated at reflux under irradiation with a tungsten lamp (300 W) for 12 hours. The reaction mixture was then concentrated in vacuo. The resulting residue was purified by chromatography on a silica gel (1.2 kg) column using a 1:9 mixture of ethyl acetate and toluene as the eluant to afford 3.46 g (yield 19%) of the title compound as pale brown needle-like crystals which were collected by filtration.

후처리

  1. concentrationAt the end of this time, the reaction mixture was concentrated to dryness in vacuo
  2. customThe resulting residue was purified by chromatography on a silica gel (250 g) column
  3. customto give

출처 및 근거

ORD 기록
ord-938f0a808f554964b0d0ff799f8c6d97
출처 데이터셋
uspto-grants-2002_01
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US06337403B1

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