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Propargyl alcohol → 1-[4-(Difluoromethoxy)phenyl]-2-[3-(1,4-dihydroxybut-2-ynyl)phenyl]ethane-1,2-dione

HRID 30596
ノート
印刷プレビュー

反応式

HRID 30596 の反応式
[CH2:1]([OH:4])[C:2]#[CH:3].[Li]CCCC.[F:10][CH:11]([F:31])[O:12][C:13]1[CH:18]=[CH:17][C:16]([C:19](=[O:30])[C:20]([C:22]2[CH:23]=[C:24]([CH:27]=[CH:28][CH:29]=2)[CH:25]=[O:26])=[O:21])=[CH:15][CH:14]=1>C1COCC1.COCCOC>[F:10][CH:11]([F:31])[O:12][C:13]1[CH:18]=[CH:17][C:16]([C:19](=[O:30])[C:20]([C:22]2[CH:29]=[CH:28][CH:27]=[C:24]([CH:25]([OH:26])[C:3]#[C:2][CH2:1][OH:4])[CH:23]=2)=[O:21])=[CH:15][CH:14]=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

6

反応物 3

HCID 7859Propargyl alcoholHCID 597903033-[2-(4-Difluoromethoxyphenyl)-2-oxo-acetyl]benzaldehydeHCID 178418339Butyllithium

生成物 1

HCID 686492321-[4-(Difluoromethoxy)phenyl]-2-[3-(1,4-dihydroxybut-2-ynyl)phenyl]ethane-1,2-dione収率 29%

試薬・触媒・溶媒 2

HCID 8028Tetrahydrofuran溶媒
HCID 8071
1,2-Dimethoxyethane
溶媒

反応条件

温度
0 °C

実験手順

A stirred solution of propargyl alcohol (0.1 g, 1.78 mmol) in dry THF at −78° C. under nitrogen was treated dropwise with 1.9 M n-BuLi (1.88 mL, 3.57 mmol) over 10 min, stirred for 0.5 h and warmed to 0° C. A 3 mL portion of this solution was added to a stirred solution of 3-[2-(4-difluoromethoxyphenyl)-2-oxo-acetyl]benzaldehyde (0.15 g, 0.49 mmol) in dry DME at 0° C. under nitrogen. After 10 min, the reaction mixture was quenched with saturated ammonium chloride, diluted with water and extracted with ethyl acetate. The combined extracts were dried over MgSO4 and concentrated in vacuo. Purification of the resultant residue by flash chromatography (30% to 70% ethyl acetate/petroleum ether) gave 1-[4-(difluoromethoxy)phenyl]-2-[3-(1,4-dihydroxybut-2-ynyl)phenyl]ethane-1,2-dione as a clear oil, 52 mg (29% yield). Using essentially the same procedure described in Example 1, step c, and employing 1-[4-(difluoromethoxy)phenyl]-2-[3-(1,4-dihydroxybut-2-ynyl)phenyl]ethane-1,2-dione (0.052 g, 0.14 mmol), the title compound was obtained as a slight brown foam, 0.031 g (52% yield), identified by NMR and mass spectral analyses. MS (ES+): 416 (M+H).

後処理

  1. waitAfter 10 min
  2. customthe reaction mixture was quenched with saturated ammonium chloride
  3. additiondiluted with water
  4. extractionextracted with ethyl acetate
  5. dry with materialThe combined extracts were dried over MgSO4
  6. concentrationconcentrated in vacuo
  7. customPurification of the resultant residue by flash chromatography (30% to 70% ethyl acetate/petroleum ether)

出典と根拠

ORDレコード
ord-b06db1c4157d499cb9340fa10473eb08
出典データセット
uspto-grants-2008_09
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US07423158B2

反応ノート

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