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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 492004생성일: 2026년 10월 23일

Ethanol → ethyl 3-(5-amino-3-tert-butyl-1H-pyrazol-1-yl)benzoate

https://huagongshe.com/ko/reaction/492004

반응식

참여 물질

역할이름HCID투입량
반응물EthanolHCID 702—
반응물Pentanenitrile, 4,4-dimethyl-3-oxo-HCID 108871—
반응물3-Hydrazinobenzoic acid hydrochlorideHCID 12891863—
생성물3-(3-tert-butyl-5-amino-1H-pyrazol-1-yl)benzoic acidHCID 2186728436%
생성물ethyl 3-(5-amino-3-tert-butyl-1H-pyrazol-1-yl)benzoateHCID 2186732240%

반응 단계

A mixture of 3-hydrazino-benzoic acid hydrochloride (200 g, 1.06 mol) and 4,4-dimethyl-3-oxo-pentanenitrile (146 g, 1.167 mol) in ethanol (2 L) was heated to reflux overnight. The reaction solution was evaporated under reduced pressure. The residue was purified by column chromatography to give 3-(5-amino-3-t-butyl-pyrazol-1-yl)-benzoic acid ethyl ester (116 g, 40%) as a white solid together with 3-(5-amino-3-t-butyl-pyrazol-1-yl)-benzoic acid (93 g, 36%). 3-(5-amino-3-t-butyl-pyrazol-1-yl)-benzoic acid and ethyl ester: 1H NMR (DMSO-d6): 8.09 (s, 1H), 8.05 (brd, J=8.0 Hz, 1H), 7.87 (br d, J=8.0 Hz, 1H), 7.71 (t, J=8.0 Hz, 1H), 5.64 (s, 1H), 4.35 (q, J=7.2 Hz, 2H), 1.34 (t, J=7.2 Hz, 3H), 1.28 (s, 9H).

출처 및 근거

DOI10.6084/m9.figshare.5104873.v1
특허 번호US07531566B2
출처 데이터셋uspto-grants-2009_05
ORD IDord-6ab6eb51d56243dba52455e00eafc2e4
출처 메모uspto-grants-2009_05