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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 1091669생성일: 2026년 10월 27일

Potassium Carbonate → 2-[6-carboxybenzothiazol-2(3H)-ylidene]-2-(4-trifluoromethyl-pyrimidin-2-yl)acetonitrile

https://huagongshe.com/reaction/1091669

반응식

참여 물질

역할이름HCID투입량
반응물Potassium CarbonateHCID 11430—
반응물4-Amino-3-mercaptobenzoic acidHCID 598058—
반응물3,3-Bis(methylthio)-2-(4-trifluoromethylpyrimidin-2-yl)acrylonitrileHCID 86640517—
촉매4-(Dimethylamino)pyridineHCID 14284—
용매EthanolHCID 702—
용매DichloromethaneHCID 6344—
생성물2-[6-carboxybenzothiazol-2(3H)-ylidene]-2-(4-trifluoromethyl-pyrimidin-2-yl)acetonitrileHCID 6659354644.5%

반응 조건

온도160 °C

반응 단계

A mixture of 4-amino-3-mercaptobenzoic acid (768 mg, 4.5 mmol), 3,3-bis(methylthio)-2-(4-trifluoromethylpyrimidin-2-yl)acrylonitrile (1.45 g, 5.0 mmol, 1.1 eq.), 4-dimethylaminopyridine (550 mg, 4.5 mmol, 1 eq.), and potassium carbonate (622 mg, 4.5 mmol, 1 eq.) in ethanol (20 mL) was heated at 160° C. for 0.4 hr in a microwave. The mixture was cooled to room temperature, diluted with DCM, and washed with 1M hydrochloric acid. The DCM fraction was decanted, filtered, and concentrated under vacuum to give 2-[6-carboxybenzothiazol-2(3H)-ylidene]-2-(4-trifluoromethyl-pyrimidin-2-yl)acetonitrile (729 mg, 40% yield) as a brown solid.

출처 및 근거

DOI10.6084/m9.figshare.5104873.v1
특허 번호US08129396B2
출처 데이터셋uspto-grants-2012_03
ORD IDord-b32016c9a04f42898ca8ce3fbc4e6282
출처 메모uspto-grants-2012_03