Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 573922생성일: 2026년 10월 26일
1,2-Dibromopropane → (1Z)-1-[3-(2-ethyl-5-methylphenyl)-4-methyl-1,3-thiazolidin-2-ylidene]-3-[2-[4-[1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]phenyl]ethyl]urea
https://huagongshe.com/reaction/573922
참여 물질
| 역할 | 이름 | HCID | 투입량 |
|---|
| 반응물 | 1,2-Dibromopropane | HCID 6553 | — |
| 반응물 | Cesium carbonate | HCID 10796 | — |
| 반응물 | Potassium Carbonate | HCID 11430 | — |
| 반응물 | 3-(4-(2-Isocyanatoethyl)phenyl)-1-(4-(trifluoromethoxy)phenyl)-1H-1,2,4-triazole | HCID 90404408 | — |
| 반응물 | 1-(2-Ethyl-5-methylphenyl)thiourea | HCID 90404560 | — |
| 용매 | Water | HCID 962 | — |
| 용매 | Acetonitrile | HCID 6342 | — |
| 용매 | Methyl Ethyl Ketone | HCID 6569 | — |
| 생성물 | (1Z)-1-[3-(2-ethyl-5-methylphenyl)-4-methyl-1,3-thiazolidin-2-ylidene]-3-[2-[4-[1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl]phenyl]ethyl]urea | HCID 90412375 | 13.3% |
반응 단계
3-(4-(2-Isocyanatoethyl)phenyl)-1-(4-(trifluoromethoxy)phenyl)-1H-1,2,4-triazole (C34a)(0.16 g, 0.42 mmol), 1-(2-ethyl-5-methylphenyl)thiourea (CA41) (0.081 g, 0.42 mmol), and cesium carbonate (0.13 g, 0.39 mmol) in acetonitrile (1.9 mL) was stirred at room temperature for 3 hours. The reaction was diluted with butanone (2 mL) and potassium carbonate (0.12 g, 0.83 mmol) and 1,2-dibromopropane (0.090 mL, 0.83 mmol) were added. The reaction was heated to 60° for 6 hours. The reaction was diluted with water and extracted with dichloromethane (2×) and the organic layers were filtered through a phase separator and concentrated. Purification by flash column chromatography using 0-100% ethyl acetate/B, where B=1:1 dichloromethane/hexanes, as eluent provided the title compound as a yellow oil (0.034 g, 13%).
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| 특허 번호 | US09029560B2 |
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| 출처 데이터셋 | uspto-grants-2015_05 |
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| ORD ID | ord-e4f714b057a64eeb980a51783f9a5f4c |
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| 출처 메모 | uspto-grants-2015_05 |
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