تفاعل #59434

ord-d7ace11d3202418a94aa69cd11dd3dc1

الكواشف

لا شيء

ظروف التفاعل

الظروف التفصيلية
See reaction.notes.procedure_details.

المعالجة

  1. 1
    أخرىa precipitate was formed
  2. 2
    درجة الحرارةThe reaction mixture was heated
  3. 3
    درجة الحرارةat reflux for 16 hours
  4. 4
    ترشيحIt was then filtered
  5. 5
    أخرىto remove the precipitate
  6. 6
    تركيزconcentrated under reduced pressure
  7. 7
    أخرىsolid sodium bromide was removed by filtration
  8. 8
    غسيلThe dichloromethane filtrate was then washed with water (100 ml) and brine (100 ml)
  9. 9
    أخرىThe organic layer was collected
  10. 10
    تجفيفdried over magnesium sulphate
  11. 11
    تركيزconcentrated under reduced pressure
  12. 12
    أخرىto give an orange solid
  13. 13
    ترشيحfiltered off

الإجراء التجريبي

Sodium hydride (60% dispersion in oil, 3.43 g, 86 mmol) was added to a solution of 3,5-heptanedione (10 g, 78 mmol), in 2-butanone (200 ml), under nitrogen. A slight exotherm was observed during gas evolution. Sodium iodide (11.7 g, 78 mmol) was then added, followed by 4-cyanobenzyl bromide (15.29 g, 78 mmol) in 2-butanone (20 ml) and a precipitate was formed. The reaction mixture was heated at reflux for 16 hours. It was then filtered to remove the precipitate and concentrated under reduced pressure. The residue was stirred in dichloromethane (100 ml) and solid sodium bromide was removed by filtration. The dichloromethane filtrate was then washed with water (100 ml) and brine (100 ml). The organic layer was collected, dried over magnesium sulphate and concentrated under reduced pressure to give an orange solid. This was slurried in diethyl ether and filtered off to provide the title compound (11.01 g, 58%) as a pale yellow solid. 1H-NMR (400 MHz, CDCl3): δ=0.98 (t, 6H), 2.29-2.35 (m, 2H), 2.42-2.52 (m, 2H), 3.19 (d, 2H), 3.97 (t, 1H), 7.25 (d, 2H), 7.56 (d, 2H); LRMS: APCl−: m/z 242 [M−H].

المصدر

DOI: 10.6084/m9.figshare.5104873.v1براءة الاختراع: US07425569B2uspto-grants-2008_09