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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 349270생성일: 2026년 10월 24일

Water → 1-(3,5-Bis-trifluoromethyl-benzyl)-5-pyridin-3-yl-1H-imidazole-4-carboxylic acid methyl ester

https://huagongshe.com/ko/reaction/349270

반응식

참여 물질

역할이름HCID투입량
반응물WaterHCID 962—
반응물Sulfuric AcidHCID 1118—
반응물Sodium BicarbonateHCID 516892—
반응물1-(3,5-Bis-trifluoromethyl-benzyl)-5-pyridin-3-yl-1H-imidazole-4-carbonitrileHCID 86601221—
용매MethanolHCID 887—
생성물1-(3,5-Bis-trifluoromethyl-benzyl)-5-pyridin-3-yl-1H-imidazole-4-carboxylic acid methyl esterHCID 86601224—

반응 조건

온도100 °C

반응 단계

In a pressure vessel dissolve 1-(3,5-Bis-trifluoromethyl-benzyl)-5-pyridin-3-yl-1H-imidazole-4-carbonitrile (0.043 g, 0.11 mmol) in MeOH (1 mL), add H2O (0.1 mL), and concentrated sulfuric acid (0.3 mL), and stir at 100° C. After 24 h., neutralize with sat. aq. NaHCO3, and extract with EtOAc (3×). Dry over MgSO4, filter, and concentrate. Purify by radial chromatography on silica gel to give the title compound: MS (ES) 430.2 (M+1); 1H NMR (300 MHz, CDCl3): δ 8.68 (ap d, 1H), 8.52 (ap d, 1H), 7.80 (s, 1H), 7.78 (s, 1H), 7.56 (d, J=7.8 Hz, 1H), 7.37 (m, 1H), 7.29 (s, 2H), 5.30 (s, 2H), 3.81 (s, 3H).

출처 및 근거

DOI10.6084/m9.figshare.5104873.v1
특허 번호US07179804B2
출처 데이터셋uspto-grants-2007_02
ORD IDord-37781fbf248e4980b6e6f700e9a536df
출처 메모uspto-grants-2007_02