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Dimethylformamide → 5-Formyl-2,4-dimethylbenzoic acid

HRID 541198
ノート
印刷プレビュー

反応式

HRID 541198 の反応式
I[C:2]1[C:3]([CH3:12])=[CH:4][C:5]([CH3:11])=[C:6]([CH:10]=1)[C:7]([OH:9])=[O:8].[Li]CCCC.CN([CH:21]=[O:22])C>O1CCCC1>[CH:21]([C:2]1[C:3]([CH3:12])=[CH:4][C:5]([CH3:11])=[C:6]([CH:10]=1)[C:7]([OH:9])=[O:8])=[O:22]
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

5

反応物 3

HCID 6228DimethylformamideHCID 230918755-Iodo-2,4-dimethylbenzoic acid2 回HCID 178418339Butyllithium

生成物 1

HCID 717431195-Formyl-2,4-dimethylbenzoic acid収率 74.4%

試薬・触媒・溶媒 1

HCID 8028Tetrahydrofuran溶媒

反応条件

温度
-78 °C

実験手順

To a stirred solution of 5-iodo-2,4-dimethylbenzoic acid (compound 2.1, 5 g, 18.11 mmol, 1.00 equiv) in tetrahydrofuran (150 mL) under nitrogen at −78° C. was added n-BuLi (2.5 M in THF, 18 mL, 2.50 equiv) dropwise. After stirring at −78° C. for 1 h, DMF (5 g, 68.4 mmol, 3.80 equiv) was added dropwise. The resulting mixture was stirred at −78° C. for an additional 0.5 h and then carefully quenched by slow addition of 50 mL of water. The pH was then adjusted to ˜3-4 using aqueous HCl (aq., 6 M). The mixture was extracted with 3×200 mL of ethyl acetate. The combined organic layers were dried (Na2SO4) and concentrated under reduced pressure. The residue thus obtained was purified using silica gel column chromatography with ethyl acetate/petroleum ether (1:10-1:5) as gradient to yield 2.4 g (74%) of the title compound as a white solid.

後処理

  1. stirringThe resulting mixture was stirred at −78° C. for an additional 0.5 h
  2. customcarefully quenched by slow addition of 50 mL of water
  3. extractionThe mixture was extracted with 3×200 mL of ethyl acetate
  4. dry with materialThe combined organic layers were dried (Na2SO4)
  5. concentrationconcentrated under reduced pressure
  6. customThe residue thus obtained
  7. customwas purified

出典と根拠

ORDレコード
ord-c5e80126c5d6463eb914dc8b8dd4b680
出典データセット
uspto-grants-2014_10
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08871790B2

反応ノート

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