Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 230695생성일: 2026년 10월 26일
N,N-Dimethylglycine → 1-[4-(1,3-oxazol-5-yl)phenyl]-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazole
https://huagongshe.com/reaction/230695
참여 물질
| 역할 | 이름 | HCID | 투입량 |
|---|
| 반응물 | N,N-Dimethylglycine | HCID 673 | — |
| 반응물 | Potassium Carbonate | HCID 11430 | — |
| 반응물 | 5-(4-Bromophenyl)-1,3-oxazole | HCID 2776418 | — |
| 반응물 | 3-(Trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazole | HCID 2802863 | — |
| 촉매 | Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI) | HCID 24350 | — |
| 용매 | Dimethyl Sulfoxide | HCID 679 | — |
| 생성물 | 1-[4-(1,3-oxazol-5-yl)phenyl]-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazole | HCID 24826365 | 30% |
반응 단계
A mixture of 3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazole (152 mg, 0.8 mmol), 5-(4-bromophenyl)-1,3-oxazole (179 mg, 0.8 mmol), N,N-dimethylglycine (16 mg, 0.16 mmol), copper (I) iodide (16 mg, 0.08 mmol), potassium carbonate (235 mg, 1.7 mmol) in dimethylsulfoxide (3 ml) was heated in a microwave reactor at 180° C. for a total of 60 minutes. The reaction mixture was then filtered through a 5 g sep-pack column with 40 ml 1:1 ethyl acetate in petroleum ether. The solvent was removed by rotary evaporation and the residue partitioned between ethyl acetate (20 ml) and water (20 ml). The organic layer was retained and washed with brine (2×10 ml). The organic material was then purified by MDAP. The relevant fractions were combined and the solvent removed by rotary evaporation to give the named products. Product was then partitioned between dichloromethane (40 ml) and water (40 ml). The organic layer was retained and the solvent removed by rotary evaporation to give the title compound (80 mg, 30%).
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| 특허 번호 | US07566735B2 |
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| 출처 데이터셋 | uspto-grants-2009_07 |
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| ORD ID | ord-f0504046b0664de48c6972c1ad583d71 |
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| 출처 메모 | uspto-grants-2009_07 |
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