홈MCP워크벤치Skills
홈워크벤치알림마이페이지
llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
  1. 홈
  2. /반응

Water → ethyl 1-ethyl-1H-indazole-5-carboxylate

HRID 73076
노트
인쇄 미리보기

반응식

HRID 73076 반응식
[NH:1]1[C:9]2[C:4](=[CH:5][C:6]([C:10]([OH:12])=[O:11])=[CH:7][CH:8]=2)C=N1.[C:13]([O-])([O-])=O.[Cs+].[Cs+].I[CH2:20][CH3:21].O.C[N:24]([CH:26]=O)[CH3:25]>>[CH2:26]([N:24]1[CH:25]=[C:4]2[C:9]([CH:8]=[CH:7][C:6]([C:10]([O:12][CH2:20][CH3:21])=[O:11])=[CH:5]2)=[N:1]1)[CH3:13].[CH2:26]([N:24]1[C:25]2[C:8](=[CH:7][C:6]([C:10]([O:12][CH2:20][CH3:21])=[O:11])=[CH:5][CH:4]=2)[CH:9]=[N:1]1)[CH3:13]
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

7

반응물 5

HCID 962WaterHCID 6228DimethylformamideHCID 6340IodoethaneHCID 10796Cesium carbonateHCID 42484541H-Indazole-5-carboxylic acid

생성물 2

HCID 66837854ethyl 1-ethyl-1H-indazole-5-carboxylate수율 65%
HCID 66837900
ethyl 2-ethyl-2H-indazole-5-carboxylate
수율 31%

실험 절차

To a suspension of 1H-indazole-5-carboxylic acid (500 mg, 3.08 mmol) and Cs2CO3 (2.01 g, 6.17 mmol) in DMF (10 mL) was added iodoethane (1.92 g, 12.33 mmol) at room temperature. The mixture was stirred at room temperature for 1 day. The mixture was poured into H2O, extracted with EtOAc, dried over Na2SO4, filtered and concentrated. The residual oil was purified by silica gel column chromatography (0-60% EtOAc in hexane) to give ethyl 2-ethyl-2H-indazole-5-carboxylate (208 mg, 31%) as a white solid and ethyl 1-ethyl-1H-indazole-5-carboxylate (435 mg, 65%) as a white solid.

후처리

  1. extractionextracted with EtOAc
  2. dry with materialdried over Na2SO4
  3. filtrationfiltered
  4. concentrationconcentrated
  5. customThe residual oil was purified by silica gel column chromatography (0-60% EtOAc in hexane)

출처 및 근거

ORD 기록
ord-df34564870fa44b9bea4bfa8153490d0
출처 데이터셋
uspto-grants-2014_09
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08829026B2

반응 노트

불러오는 중…

이 페이지에서참가 물질실험 절차후처리출처 및 근거반응 노트