Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
2-Nitroimidazole → Tert-butyl-(2-nitro-imidazol-1-yl)acetate
참여 물질
| 역할 | 이름 | HCID | 투입량 |
|---|---|---|---|
| 반응물 | 2-Nitroimidazole | HCID 10701 | — |
| 반응물 | Potassium Carbonate | HCID 11430 | — |
| 반응물 | tert-Butyl bromoacetate | HCID 79177 | — |
| 용매 | Acetonitrile | HCID 6342 | — |
| 생성물 | Tert-butyl-(2-nitro-imidazol-1-yl)acetate | HCID 14555697 | 71% |
반응 단계
To a mixture of 2-nitroimidazole 1 (17.7 mmol, 1 equiv.) and anhydrous potassium carbonate (70.74 mmol, 4 equiv.) in 20 mL of acetonitrile is added dropwise a solution of tert-butylbromoacetate (17.7 mmol, 1 equiv.) in 10 ml of acetonitrile. The mixture is stirred one night at room temperature and concentrated under vacuum. The residue is purified by chromatography on silica gel using a mixture CH2Cl2/MeOH 95/5 as eluent to give the expected compound as white powder in 71% yield. mp 95-97° C.; 1H NMR (DMSO-d6, 400 MHz) δ 1.46 (s, 9H), 4.99 (s, 2H), 7.06 (d, 1H, J=1.01 Hz), 7.17 (d, 1H, J=1.01 Hz). MS (ESI+/ESI−) m/z 226.15 [M−H]−, 262.13 [M+Cl]−, 250.20 [M+H]+
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| 특허 번호 | US08980932B2 |
| 출처 데이터셋 | uspto-grants-2015_03 |
| ORD ID | ord-c916c115c86d41d88636d19dae2e8160 |
| 출처 메모 | uspto-grants-2015_03 |