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Ammonium Chloride → 4-((5-Chloro-furan-2-yl)-hydroxy-methyl)-benzonitrile

HRID 77954
ノート
印刷プレビュー

反応式

HRID 77954 の反応式
I[C:2]1[CH:9]=[CH:8][C:5]([C:6]#[N:7])=[CH:4][CH:3]=1.C([Mg]Cl)(C)C.[Cl:15][C:16]1[O:20][C:19]([CH:21]=[O:22])=[CH:18][CH:17]=1.[Cl-].[NH4+]>C(OCC)(=O)C.O.O1CCCC1>[Cl:15][C:16]1[O:20][C:19]([CH:21]([OH:22])[C:2]2[CH:9]=[CH:8][C:5]([C:6]#[N:7])=[CH:4][CH:3]=2)=[CH:18][CH:17]=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

8

反応物 4

HCID 25517Ammonium ChlorideHCID 764674-IodobenzonitrileHCID 27696305-Chloro-2-furaldehydeHCID 178418918HCID 178418918、化合物

生成物 1

HCID 592551164-((5-Chloro-furan-2-yl)-hydroxy-methyl)-benzonitrile収率 105.4%

試薬・触媒・溶媒 3

HCID 962Water溶媒
HCID 8028Tetrahydrofuran溶媒
HCID 8857Ethyl Acetate溶媒

反応条件

温度
0 °C

実験手順

To a mixture of 4-iodobenzonitrile (3.0 g, 13 mmol) and tetrahydrofuran (40 mL) was added dropwise isopropyl magnesium chloride (1-2 M diethyl ether solution, 11 mL, 11-22 mmol) at −78° C., which was stirred for 1 hour at 0° C. The reaction mixture was cooled to −78° C., 5-chloro-2-furaldehyde (2.2 g, 17 mmol) was added at that temperature, and the temperature was gradually raised to 0° C. Following 30 minutes of stirring at 0° C., saturated aqueous ammonium chloride solution, water and ethyl acetate were added to extract the reaction mixture. The organic layer was washed successively with saturated aqueous sodium hydrogencarbonate solution and saturated aqueous sodium chloride, and the solvent was evaporated under a reduced pressure. Ethyl acetate was added to the residue, which was then filtered with NH silica gel. The filtrate was concentrated under a reduced pressure to obtain the title compound (3.2 g) as a crude product. This compound was used in the subsequent reaction without further purification.

後処理

  1. temperatureThe reaction mixture was cooled to −78° C.
  2. temperaturethe temperature was gradually raised to 0° C
  3. waitFollowing 30 minutes
  4. stirringof stirring at 0° C.
  5. extractionto extract the reaction mixture
  6. washThe organic layer was washed successively with saturated aqueous sodium hydrogencarbonate solution and saturated aqueous sodium chloride
  7. customthe solvent was evaporated under a reduced pressure
  8. additionEthyl acetate was added to the residue, which
  9. filtrationwas then filtered with NH silica gel
  10. concentrationThe filtrate was concentrated under a reduced pressure

出典と根拠

ORDレコード
ord-33b1968853d640e6ab2a05b936b54847
出典データセット
uspto-grants-2014_09
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08841327B2

反応ノート

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