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Sodium Hydroxide → 3-(Methylamino)benzonitrile

HRID 591139
ノート
印刷プレビュー

反応式

HRID 591139 の反応式
[CH3:1]O[Na].[NH2:4][C:5]1[CH:6]=[C:7]([CH:10]=[CH:11][CH:12]=1)[C:8]#[N:9].[BH4-].[Na+].[OH-].[Na+]>CO>[CH3:1][NH:4][C:5]1[CH:6]=[C:7]([CH:10]=[CH:11][CH:12]=1)[C:8]#[N:9]
参加物実験手順後処理出典と根拠反応ノート

参加物

6

反応物 4

HCID 14798Sodium HydroxideHCID 167023-AminobenzonitrileHCID 4311764Sodium borohydrideHCID 178418582HCID 178418582、化合物

生成物 1

HCID 177940363-(Methylamino)benzonitrile収率 220.8%

試薬・触媒・溶媒 1

HCID 887Methanol溶媒3 回

実験手順

To methanol (45 ml) is added CH3ONa (4.05 g, 75 mmol, 0.5 eq), and to this solution is dropwise added a solution of 3-aminobenzonitrile (17.70 g, 150 mmol, 1.0 eq) in methanol (60 ml). The mixture is stirred for 0.5 h. Then the reaction mixture is poured into a solution of polyformaldehyde (6.30 g, 210 mmol, 1.4 eq) in methanol (90 ml). After stirring at room temperature for 5.0 h, NaBH4 (content 96%) (6.00 g, 150 mmol, 1.0 eq) is added in portions. The mixture is stirred at room temperature for 10 min, and then is refluxed at elevated temperature for 10 min. The reaction mixture is cooled under ice-water bath, and added with 10% NaOH (aq) (90 ml) and stirred for 5 min. Methanol is removed under reduced pressure, and the left aqueous solution is extracted with ethyl acetate (150 ml*2). The organic phases are combined, washed with saturated brine twice, dried over anhydrous sodium sulfate, and concentrated to yield 21.89 g of brown oily crude product. The crude product is purified by neutral alumina column chromatography (eluent: petroleum ether/CH2Cl2=2/1) to give a light yellow oily pure product (17.34 g, yield: 87.6%).

後処理

  1. stirringAfter stirring at room temperature for 5.0 h
  2. stirringThe mixture is stirred at room temperature for 10 min
  3. temperatureis refluxed at elevated temperature for 10 min
  4. temperatureThe reaction mixture is cooled under ice-water bath
  5. stirringstirred for 5 min
  6. customMethanol is removed under reduced pressure
  7. extractionthe left aqueous solution is extracted with ethyl acetate (150 ml*2)
  8. washwashed with saturated brine twice
  9. dry with materialdried over anhydrous sodium sulfate
  10. concentrationconcentrated

出典と根拠

ORDレコード
ord-20cc8053a8d84632badb516e62a5075d
出典データセット
uspto-grants-2016_01
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US09238632B2

反応ノート

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