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Methanol → HCID 21904789、化合物

HRID 1246721
ノート
印刷プレビュー

反応式

HRID 1246721 の反応式
[CH:1]([N-:4][CH:5]([CH3:7])C)([CH3:3])C.[Li+].[F:9][C:10]([F:25])([F:24])[C:11]1[C:12](N2CCC(=O)CC2)=[N:13][CH:14]=[CH:15][CH:16]=1.[C:26]1(N(S(C(F)(F)F)(=O)=O)S(C(F)(F)F)(=O)=O)[CH:31]=CC=CC=1.C(N(CC)CC)C.[CH3:54][OH:55].[C]=[O:57]>C1COCC1.Cl[Pd](Cl)([P](C1C=CC=CC=1)(C1C=CC=CC=1)C1C=CC=CC=1)[P](C1C=CC=CC=1)(C1C=CC=CC=1)C1C=CC=CC=1.CN(C=O)C>[F:25][C:10]([F:9])([F:24])[C:11]1[C:12]([N:4]2[CH2:1][CH:3]=[C:31]([C:26]([O:55][CH3:54])=[O:57])[CH2:7][CH2:5]2)=[N:13][CH:14]=[CH:15][CH:16]=1
参加物反応条件実験手順後処理出典と根拠反応ノート

参加物

10

反応物 6

HCID 887MethanolHCID 8471TriethylamineHCID 142176Phenyl triflimideHCID 2724682Lithium diisopropylamideHCID 219047511-(3-(Trifluoromethyl)pyridin-2-YL)piperidin-4-oneHCID 178418416HCID 178418416、化合物

生成物 1

HCID 21904789
HCID 21904789、化合物

試薬・触媒・溶媒 3

HCID 178418476HCID 178418476、化合物触媒HCID 6228Dimethylformamide溶媒HCID 8028Tetrahydrofuran溶媒2 回

反応条件

温度
80 °C

実験手順

Lithium diisopropyl amide (37.3 mmol) in THF (75 mL) at −78° C. was treated with 1-[3-(trifluoromethyl)pyridin-2-yl]piperidin-4-one (8.30 g, 34.0 mmol) in THF (25 mL) and stirred for 45 minutes. The mixture was treated with solid PhNTf2 (14.0 g, 39.1 mmol), stirred for 1 hour, and concentrated under reduced pressure. The residue was diluted with ethyl acetate:hexanes (1:1), washed with 1N NaOH, dried (Na2SO4), filtered through a silica plug, and the filtrate was concentrated under reduced pressure. The residue, triethylamine (14.2 mL, 102 mmol), and PdCl2(PPh3)2 (0.944 g, 1.34 mmol) were combined in methanol (7.00 mL, 173 mmol) and DMF (100 mL) and saturated with carbon monoxide gas (bubbling 15 minutes). The mixture was heated at 80° C. under a carbon monoxide atmosphere (1 atm) overnight. The mixture was concentrated to half volume, diluted with diethyl ether, washed with water, brine, dried (Na2SO4), filtered, and the filtrate was concentrated under reduced pressure. The residue was purified by flash chromatography (6% ethyl acetate/hexanes) to provide the title compound.

後処理

  1. stirringstirred for 1 hour
  2. concentrationconcentrated under reduced pressure
  3. additionThe residue was diluted with ethyl acetate:hexanes (1:1)
  4. washwashed with 1N NaOH
  5. dry with materialdried (Na2SO4)
  6. filtrationfiltered through a silica plug
  7. concentrationthe filtrate was concentrated under reduced pressure
  8. concentrationThe mixture was concentrated to half volume
  9. additiondiluted with diethyl ether
  10. washwashed with water, brine
  11. dry with materialdried (Na2SO4)
  12. filtrationfiltered
  13. concentrationthe filtrate was concentrated under reduced pressure
  14. customThe residue was purified by flash chromatography (6% ethyl acetate/hexanes)

出典と根拠

ORDレコード
ord-b602bba1299042368083582d15cfbf12
出典データセット
uspto-grants-2006_10
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US07129235B2

反応ノート

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