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Azobisisobutyronitrile → 1-(Bromomethyl)-2-(difluoromethyl)benzene

HRID 1965399
ノート
印刷プレビュー

反応式

HRID 1965399 の反応式
[F:1][CH:2]([F:10])[C:3]1[CH:8]=[CH:7][CH:6]=[CH:5][C:4]=1[CH3:9].[Br:11]N1C(=O)CCC1=O.N(C(C)(C)C#N)=NC(C)(C)C#N>C(Cl)(Cl)(Cl)Cl.ClCCl>[Br:11][CH2:9][C:4]1[CH:5]=[CH:6][CH:7]=[CH:8][C:3]=1[CH:2]([F:10])[F:1]
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 3

HCID 6547Azobisisobutyronitrile2 回HCID 67184N-bromobutanimideHCID 17847229HCID 17847229、化合物

生成物 1

HCID 226714721-(Bromomethyl)-2-(difluoromethyl)benzene

試薬・触媒・溶媒 2

HCID 5943Carbon Tetrachloride溶媒HCID 6344Dichloromethane溶媒

実験手順

To a solution of 1-(difluoromethyl)-2-methylbenzene (2.90 g, 20.4 mmol) in carbon tetrachloride (50 mL) was added N-bromosuccinimide (3.63 g, 20.4 mmol) and 2,2′-azobis(2-methylpropionitrile) (0.167 g, 1.02 mmol). The mixture was heated at reflux for 16 h. Further 2,2′-azobis(2-methylpropionitrile) (0.167 g, 1.02 mmol) was added, the mixture was heated at reflux for 4 h, allowed to cool to ambient temperature, diluted with dichloromethane (175 mL) and washed with water (2×175 mL) and saturated sodium bicarbonate (150 mL). The organic phase was dried over sodium sulfate, filtered, and concentrated in vacuo. The resultant residue was purified by column chromatography and eluted with a 0% to 10% gradient of ethyl acetate in dichloromethane to afford 1-(bromomethyl)-2-(difluoromethyl)benzene as a yellow solid: 1H NMR (300 MHz, CDCl3) δ7.58-7.56 (m, 1H), 7.43-7.37 (m, 3H), 6.95 (t, 55.2 Hz, 1H), 4.59 (s, 2H).

後処理

  1. temperatureThe mixture was heated
  2. temperatureat reflux for 16 h
  3. temperaturethe mixture was heated
  4. temperatureat reflux for 4 h
  5. washwashed with water (2×175 mL) and saturated sodium bicarbonate (150 mL)
  6. dry with materialThe organic phase was dried over sodium sulfate
  7. filtrationfiltered
  8. concentrationconcentrated in vacuo
  9. customThe resultant residue was purified by column chromatography
  10. washeluted with a 0% to 10% gradient of ethyl acetate in dichloromethane

出典と根拠

ORDレコード
ord-76202e45c65c4615a5de575382b1f692
出典データセット
uspto-grants-2013_04
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08415370B2

反応ノート

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