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

Trifluoromethanesulfonic acid → 6-Methoxy-2'-oxo-1',2'-dihydrospiro[1-benzofuran-3,3'-indole]-5-carbonitrile

HRID 1407632
ノート
印刷プレビュー

反応式

HRID 1407632 の反応式
[CH3:1][O:2][C:3]1[C:8]([C:9]#[N:10])=[CH:7][C:6]2[C:11]3([CH2:30][O:31][C:5]=2[CH:4]=1)[C:19]1[C:14](=[CH:15][CH:16]=[CH:17][CH:18]=1)[N:13](CC1C=CC(OC)=CC=1)[C:12]3=[O:29].FC(F)(F)S(O)(=O)=O>ClCCl.FC(F)(F)C(O)=O>[CH3:1][O:2][C:3]1[C:8]([C:9]#[N:10])=[CH:7][C:6]2[C:11]3([CH2:30][O:31][C:5]=2[CH:4]=1)[C:19]1[C:14](=[CH:15][CH:16]=[CH:17][CH:18]=1)[NH:13][C:12]3=[O:29]
参加物実験手順後処理出典と根拠反応ノート

参加物

5

反応物 2

HCID 62406Trifluoromethanesulfonic acidHCID 593526926-Methoxy-1'-(4-methoxybenzyl)-2'-oxo-1',2'-dihydrospiro[1-benzofuran-3,3'-indole]-5-carbonitrile

生成物 1

HCID 593524576-Methoxy-2'-oxo-1',2'-dihydrospiro[1-benzofuran-3,3'-indole]-5-carbonitrile収率 96.9%

試薬・触媒・溶媒 2

HCID 6344Dichloromethane溶媒HCID 6422Trifluoroacetic acid
溶媒

実験手順

To a stirred solution of 6-methoxy-1′-(4-methoxybenzyl)-2′-oxo-1′,2′-dihydrospiro[1-benzofuran-3,3′-indole]-5-carbonitrile (0.50 g, 1.2 mmol) in dichloromethane (5 mL) and trifluoroacetic acid (5 mL) was added trifluoromethanesulfonic acid (1.0 mL, 11 mmol). The reaction mixture was stirred at ambient temperature for 18 h and concentrated in vacuo. The residue was basified with saturated aqueous sodium bicarbonate and extracted with ethyl acetate. The organic phase was washed with water and brine, dried over anhydrous sodium sulfate and filtered. The filtrate was concentrated in vacuo. The residue was purified by column chromatography to afford 6-methoxy-2′-oxo-1′,2′-dihydrospiro[1-benzofuran-3,3′-indole]-5-carbonitrile (0.34 g, 96%): mp 185-186° C.; 1H NMR (300 MHz, CDCl3) δ 8.46 (s, 1H), 7.30-7.25 (m, 1H), 7.11-7.03 (m, 2H), 6.97-6.94 (m, 2H), 6.56 (s, 1H), 4.91 (ABq, 2H), 3.90 (s, 3H); MS (ES+) m/z 292.9 (M+1).

後処理

  1. concentrationconcentrated in vacuo
  2. extractionextracted with ethyl acetate
  3. washThe organic phase was washed with water and brine
  4. dry with materialdried over anhydrous sodium sulfate
  5. filtrationfiltered
  6. concentrationThe filtrate was concentrated in vacuo
  7. customThe residue was purified by column chromatography

出典と根拠

ORDレコード
ord-388017222c6a4088b19a5e0983f11d17
出典データセット
uspto-grants-2014_12
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08916580B2

反応ノート

読み込み中…

このページの内容参加物実験手順後処理出典と根拠反応ノート