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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 1270528생성일: 2026년 10월 25일

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

https://huagongshe.com/reaction/1270528

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 번호US07202257B2
출처 데이터셋uspto-grants-2007_04
ORD IDord-b321b983b7c44ea4aa767ec5c17af5cd
출처 메모uspto-grants-2007_04