ホームMCPワークベンチSkills
ホームワークベンチ通知マイページ
llms.txt · MCPガイドプライバシーポリシー · 利用規約 · サポートv1.8.0
  1. ホーム
  2. /反応

Sodium Chloride → 5-(1-Methyl-1-phenylethyl)oxazole

HRID 29518
ノート
印刷プレビュー

反応式

HRID 29518 の反応式
[CH3:1][N+:2]#[C-:3].[Li]CCCC.CCCCCC.[CH3:15][C:16]([C:21]1[CH:26]=[CH:25][CH:24]=[CH:23][CH:22]=1)([CH3:20])[C:17](Cl)=[O:18].[Na+].[Cl-]>C1COCC1>[CH3:20][C:16]([C:17]1[O:18][CH:1]=[N:2][CH:3]=1)([C:21]1[CH:26]=[CH:25][CH:24]=[CH:23][CH:22]=1)[CH3:15]
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

7

反応物 5

HCID 5234Sodium ChlorideHCID 8058HexaneHCID 11646Methyl isocyanideHCID 123690862-Methyl-2-phenylpropanoyl chlorideHCID 178418339Butyllithium

生成物 1

HCID 597887885-(1-Methyl-1-phenylethyl)oxazole収率 54%

試薬・触媒・溶媒 1

HCID 8028
Tetrahydrofuran
溶媒

反応条件

温度
-78 °C

実験手順

To a solution of methyl isocyanide (1.3 mmol, 1.3 eq.) in THF (5 mL) at −78° C. was added dropwise a solution of n-BuLi in Hexane (2.5 M, 1.3 mmol, 1.3 eq.). The resulting yellowish solution was stirred at −78° C. for an additional 45 min and 2-Methyl-2-phenylpropionyl chloride (1.0 mmol, 1.0 eq.) was slowly added. The mixture was stirred at −78° C. for an additional 1 h and allowed to warm to room temperature followed by the addition of saturated aqueous NaCl solution (5 mL). The mixture was extracted by EtOAc (3×5 mL) and the combined organic extracts were washed by saturated aqueous NaCl solution, dried by Na2SO4, filtered and evaporated in vacuo. The residue was further purified by flash chromatography (silica gel, 10% EtOAc/Hexanes) to afford 5-(1-Methyl-1-phenylethyl)oxazole as a colorless oil (101 mg, 54%). 1H NMR: δ (400 MHz, CDCl3) 7.74 (s,1H), 7.30 (m, 2H), 7.23 (m, 3H), 6.85 (s,1H), 1.69 (s, 6H). MS (M+H+): 188.1

後処理

  1. stirringThe mixture was stirred at −78° C. for an additional 1 h
  2. temperatureto warm to room temperature
  3. extractionThe mixture was extracted by EtOAc (3×5 mL)
  4. washthe combined organic extracts were washed by saturated aqueous NaCl solution
  5. dry with materialdried by Na2SO4
  6. filtrationfiltered
  7. customevaporated in vacuo
  8. customThe residue was further purified by flash chromatography (silica gel, 10% EtOAc/Hexanes)

出典と根拠

ORDレコード
ord-8c9440dcf2664164a7a89d723deae290
出典データセット
uspto-grants-2008_09
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US07420055B2

反応ノート

読み込み中…

このページの内容参加物反応条件実験手順後処理出典と根拠反応ノート