تفاعل #1256723

ord-3d322a73b98d45699bdee5ef9869b9d5

معادلة التفاعل

CCCC1CCC(=O)C(C(=O)OC)C1
methyl 2-oxo-5-propylcyclohexanecarboxylate
Oc1cccc(O)c1
resorcinol
O=P(Cl)(Cl)Cl
phosphoryl chloride
O=C([O-])[O-].[K+].[K+]
potassium carbonate
CCI
ethyl iodide
CCCC1CCc2c(c(=O)oc3cc(OCC)ccc23)C1
3-ethoxy-8-propyl-7,8,9,10-tetrahydrobenzo[c]chromen-6-one

المذيبات

ظروف التفاعل

الظروف التفصيلية
See reaction.notes.procedure_details.

المعالجة

  1. 1
    درجة الحرارةthe mixture is heated
  2. 2
    درجة الحرارةunder reflux for 3 h
  3. 3
    أخرىAfter hydrolysis
  4. 4
    ترشيحthe deposited precipitate is filtered off with suction
  5. 5
    غسيلwashed with toluene
  6. 6
    أخرىdried
  7. 7
    workup.DISSOLUTIONThe product is dissolved in 200 ml of acetone
  8. 8
    درجة الحرارةthe mixture is heated
  9. 9
    درجة الحرارةunder reflux for 5 h
  10. 10
    أخرىThe majority of the solvent is removed under reduced pressure
  11. 11
    أخرىThe aqueous phase is separated off
  12. 12
    استخلاصextracted with MTB ether
  13. 13
    غسيلThe combined organic phases are washed with water
  14. 14
    تجفيفdried over sodium sulfate
  15. 15
    أخرىThe solvent is removed under reduced pressure
  16. 16
    أخرىthe crude product is recrystallised from ethanol

الإجراء التجريبي

16.6 g (78.5 mmol) of methyl 2-oxo-5-propylcyclohexanecarboxylate, 7.65 g (69.5 mmol) of resorcinol and 5.6 ml (6.1 mmol) of phosphoryl chloride are dissolved in 55 ml of toluene, and the mixture is heated under reflux for 3 h. After hydrolysis using water, the deposited precipitate is filtered off with suction, washed with toluene and dried. The product is dissolved in 200 ml of acetone, 20 g (145 mmol) of potassium carbonate and 9.00 g (57.7 mmol) of ethyl iodide are added, and the mixture is heated under reflux for 5 h. The majority of the solvent is removed under reduced pressure, and the residue is taken up in MTB ether/water. The aqueous phase is separated off and extracted with MTB ether. The combined organic phases are washed with water and dried over sodium sulfate. The solvent is removed under reduced pressure, and the crude product is recrystallised from ethanol, giving 3-ethoxy-8-propyl-7,8,9,10-tetrahydrobenzo[c]chromen-6-one as colourless crystals. The melting point is 108° C. The other physical properties are: Δ∈=−7.5 (extrapolated from 5% solution in ZLI-2857), Δn=0.1302 (5% in ZLI-4792).

المصدر

DOI: 10.6084/m9.figshare.5104873.v1براءة الاختراع: US07824745B2uspto-grants-2010_11