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

Acetic Acid → 3-[3-(3,3-Dimethyl-1-oxo-1-butyl)-5-(quinolin-2-ylmethoxy)indol-2-yl]-2,2-dimethylpropanoic acid

HRID 1590737
ノート
印刷プレビュー

反応式

HRID 1590737 の反応式
[CH3:1][C:2]([CH3:36])([CH3:35])[CH2:3][C:4]([C:6]1[C:14]2[C:9](=[CH:10][CH:11]=[C:12]([O:15][CH2:16][C:17]3[CH:26]=[CH:25][C:24]4[C:19](=[CH:20][CH:21]=[CH:22][CH:23]=4)[N:18]=3)[CH:13]=2)[NH:8][C:7]=1[CH2:27][C:28]([CH3:34])([CH3:33])[C:29]([O:31]C)=[O:30])=[O:5].[OH-].[Na+].CC(O)=O.C(O)(C)C>CO.C1COCC1.O>[CH3:1][C:2]([CH3:36])([CH3:35])[CH2:3][C:4]([C:6]1[C:14]2[C:9](=[CH:10][CH:11]=[C:12]([O:15][CH2:16][C:17]3[CH:26]=[CH:25][C:24]4[C:19](=[CH:20][CH:21]=[CH:22][CH:23]=4)[N:18]=3)[CH:13]=2)[NH:8][C:7]=1[CH2:27][C:28]([CH3:34])([CH3:33])[C:29]([OH:31])=[O:30])=[O:5]
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 176Acetic AcidHCID 3776IsopropanolHCID 14798Sodium HydroxideHCID 18947551Methyl 3-[3-(3,3-dimethyl-1-oxo-1-butyl)-5-(quinolin-2-ylmethoxy)indol-2-yl]-2,2-dimethyl-propanoate

生成物 1

HCID 197343483-[3-(3,3-Dimethyl-1-oxo-1-butyl)-5-(quinolin-2-ylmethoxy)indol-2-yl]-2,2-dimethylpropanoic acid

試薬・触媒・溶媒 3

HCID 887
Methanol
溶媒
HCID 962Water溶媒2 回
HCID 8028Tetrahydrofuran溶媒

反応条件

温度
0 °C

実験手順

The crude ester from step D was dissolved in a mixture of MeOH (20 mL), THF (20 mL), and H2O (5 mL). To this was added 10M NaOH (2.3 mL, 23 mmol). After stirring for 3 hours, the solution was cooled to 0° C., and HOAc (1.5 mL) was added dropwise. The solution was partly concentrated to remove the THF and MeOH, and the product was then extracted into EtOAc. The organic layer was washed with H2O and brine. After drying (MgSO4), the solution was filtered and evaporated to give a pale orange solid. The product was stirred vigourously with a mixture of isopropanol (30 ml) and H2O (3 mL) to give the title compound as an off-white amourphous solid (2.6 g). mp=193°-196° C. (dec)

後処理

  1. concentrationThe solution was partly concentrated
  2. customto remove the THF and MeOH
  3. extractionthe product was then extracted into EtOAc
  4. washThe organic layer was washed with H2O and brine
  5. dry with materialAfter drying (MgSO4)
  6. filtrationthe solution was filtered
  7. customevaporated
  8. customto give a pale orange solid

出典と根拠

ORDレコード
ord-72e4ef91ff8245759f12ec34c536d1f0
出典データセット
uspto-grants-1993_04
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US05204344

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