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Sodium → 5-(Tetrahydro-2H-pyran-4-YL)cyclohexane-1,3-dione

HRID 43314
ノート
印刷プレビュー

反応式

HRID 43314 の反応式
C([C:3](CC)(C([O-])=O)[C:4]([O-])=[O:5])C.[Na].[O:13]1[CH2:18][CH2:17][CH:16]([CH:19]=[CH:20][C:21](=[O:23])[CH3:22])[CH2:15][CH2:14]1>C(O)C>[O:13]1[CH2:18][CH2:17][CH:16]([CH:19]2[CH2:3][C:4](=[O:5])[CH2:22][C:21](=[O:23])[CH2:20]2)[CH2:15][CH2:14]1
参加物実験手順後処理出典と根拠反応ノート

参加物

5

反応物 3

HCID 5360545SodiumHCID 69515632,2-DiethylpropanedioateHCID 571371831-(4-Tetrahydropyranyl)but-1-en-3-one

生成物 1

HCID 189213635-(Tetrahydro-2H-pyran-4-YL)cyclohexane-1,3-dione

試薬・触媒・溶媒 1

HCID 702Ethanol溶媒2 回

実験手順

Diethylmalonate (8.86 ml, 58 mmol) is added dropwise over 3 minutes to a chilled (ice-bath) solution of sodium (1.48 g, 64 mmol) in ethanol (80 ml). Once the addition is complete the cooling bath is removed and reaction is stirred for 25 minutes at room temperature, then the reaction mixture is cooled again in an ice-bath. A solution of 4-(tetrahydropyran-4-yl)-3-buten-2-one (7.50 g, 49 mmol) in ethanol (45 ml) is added to the reaction mixture via a dropping funnel over 15 minutes. Once the addition is complete, the cooling bath is removed and the yellow solution is stirred at room temperature for 19 hours. The reaction mixture is acidified to pH 3 by dropwise addition of 2M aqueous hydrochloric acid, water added to dissolve the precipitate and the reaction mixture is extracted into dichloromethane. The organic extracts are dried over anhydrous magnesium sulphate, filtered and the filtrate concentrated in vacuo. The residue is taken up in isopropanol (50 ml) and a 2M aqueous solution of sodium hydroxide (140 ml) added. The reaction mixture is stirred at room temperature for 20 hours. The reaction mixture is concentrated in vacuo to remove isopropanol, then heated to 70° C. A solution of 2M aqueous hydrochloric acid is added carefully until the reaction mixture reaches pH 2. The reaction mixture is heated for 2½ hours at 75° C., then cooled to room temperature and the product is extracted into ethyl acetate. The organic extracts are combined, dried over anhydrous magnesium sulphate, filtered and the filtrate concentrated in vacuo to give 5-(tetrahydropyran-4-yl)cyclohexane-1,3-dione.

後処理

  1. additionOnce the addition
  2. customis removed
  3. customreaction
  4. temperaturethe reaction mixture is cooled again in an ice-bath
  5. additionOnce the addition
  6. customthe cooling bath is removed
  7. stirringthe yellow solution is stirred at room temperature for 19 hours
  8. additionThe reaction mixture is acidified to pH 3 by dropwise addition of 2M aqueous hydrochloric acid, water
  9. additionadded
  10. dissolutionto dissolve the precipitate
  11. extractionthe reaction mixture is extracted into dichloromethane
  12. dry with materialThe organic extracts are dried over anhydrous magnesium sulphate
  13. filtrationfiltered
  14. concentrationthe filtrate concentrated in vacuo
  15. additiona 2M aqueous solution of sodium hydroxide (140 ml) added
  16. stirringThe reaction mixture is stirred at room temperature for 20 hours
  17. concentrationThe reaction mixture is concentrated in vacuo
  18. customto remove isopropanol
  19. temperatureheated to 70° C
  20. additionA solution of 2M aqueous hydrochloric acid is added carefully until the reaction mixture
  21. temperatureThe reaction mixture is heated for 2½ hours at 75° C.
  22. temperaturecooled to room temperature
  23. extractionthe product is extracted into ethyl acetate
  24. dry with materialdried over anhydrous magnesium sulphate
  25. filtrationfiltered
  26. concentrationthe filtrate concentrated in vacuo

出典と根拠

ORDレコード
ord-3e6da8fd35424ffea4abb8169e554dc5
出典データセット
uspto-grants-2013_09
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08536351B2

反応ノート

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