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Ethyl cyanoacetate → 2-Cyano-hex-5-enoic acid ethyl ester

HRID 252457
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HRID 252457 반응식
[H-].[Na+].[CH2:3]([O:5][C:6](=[O:10])[CH2:7][C:8]#[N:9])[CH3:4].Br[CH2:12][CH2:13][CH:14]=[CH2:15]>CN(C=O)C>[CH2:3]([O:5][C:6](=[O:10])[CH:7]([C:8]#[N:9])[CH2:15][CH2:14][CH:13]=[CH2:12])[CH3:4]
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참가 물질

5

반응물 3

HCID 7764Ethyl cyanoacetateHCID 21241Homoallyl bromideHCID 24758Sodium hydride

생성물 1

HCID 249735162-Cyano-hex-5-enoic acid ethyl ester

시약·촉매·용매 1

HCID 6228Dimethylformamide용매

실험 절차

To a flame dried flask charged with NaH (1.4 g, 35.46 mmol, 60% dispersion in mineral oil) and DMF (90 mL) equipped with a Firestone valve and under a stream of dry nitrogen was added, dropwise ethylcyanoacetate (3.14 mL, 29.56 mmol) over 20 min. The reaction mixture was then allowed to stir for 30 min, followed by addition of 4-bromobutene (3.0 mL, 29.56 mmol). The reaction mixture was allowed to stir overnight after which the solvent was removed by reduced pressure. The resulting crude mixture was dissolved in ethyl acetate, washed 3 times with 1N HCl solution and once with a saturated solution of brine. The organic and aqueous layers were separated and the organic layer was dried with sodium sulfate, filtered and the solvent was removed under reduced pressure to yield a residue. The residue was purified by flash chromatography using a mixture of 9:1 heptanes to ethyl acetate to yield a clear colorless oil.

후처리

  1. customTo a flame dried flask
  2. customequipped with a Firestone valve and under a stream of dry nitrogen
  3. additionwas added
  4. stirringto stir overnight after which the solvent
  5. customwas removed by reduced pressure
  6. dissolutionThe resulting crude mixture was dissolved in ethyl acetate
  7. washwashed 3 times with 1N HCl solution
  8. customThe organic and aqueous layers were separated
  9. dry with materialthe organic layer was dried with sodium sulfate
  10. filtrationfiltered
  11. customthe solvent was removed under reduced pressure
  12. customto yield a residue
  13. customThe residue was purified by flash chromatography
  14. additiona mixture of 9:1 heptanes to ethyl acetate
  15. customto yield a clear colorless oil

출처 및 근거

ORD 기록
ord-0122ff853c3f42fb84cd13690f7d6972
출처 데이터셋
uspto-grants-2011_01
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US07868022B2

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