참여 물질
| 역할 | 이름 | HCID | 투입량 |
|---|
| 반응물 | Methylparaben | HCID 7456 | — |
| 반응물 | 1,3-Difluoro-5-nitrobenzene | HCID 75272 | — |
| 반응물 | Potassium tert-butoxide | HCID 23665647 | — |
| 용매 | Dimethyl Sulfoxide | HCID 679 | — |
| 용매 | Water | HCID 962 | — |
| 생성물 | 4-(3-Fluoro-5-nitro-phenoxy)-benzoic acid methyl ester | HCID 65019135 | — |
반응 단계
To a solution of 4-hydroxybenzoic acid methyl ester (3.00 g, 19.5 mmol) in DMSO (30 ml) was added t-BuOK (2.56 g, 21.5 mmol) at room temperature and the mixture was stirred at room temperature for 30 minutes under N2 flow. 1,3-Difluoro-5-nitrobenzene (2.34 ml, 20.5 mmol) was added dropwise at room temperature. The mixture was heated at 90° C. for 2 hours under N2 flow. The reaction mixture was cooled to room temperature, diluted with H2O, and then extracted with EtOAc. The extract washed with H2O and brine, dried over MgSO4, filtered and concentrated under vacuum giving the title compound as a dark brown oil, which was crystallized with i-Pr2O. The crystals were collected by filtration to give the desired product as pale yellow crystal (1.92 g, 40%). The filtrate gave additional product (1.46 g, 30%) as pale yellow crystal by silica gel column chromatography eluting with 4:1 EtOAc/hexane.
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| 특허 번호 | US08338605B2 |
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| 출처 데이터셋 | uspto-grants-2012_12 |
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| ORD ID | ord-ee703d9db1e04a788041b2a23f761049 |
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| 출처 메모 | uspto-grants-2012_12 |
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