Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
Isopropylamine → 3-isopropyl-6-(trifluoromethyl)-2,4(1H,3H)-pyrimidinedione
참여 물질
| 역할 | 이름 | HCID | 투입량 |
|---|---|---|---|
| 반응물 | Isopropylamine | HCID 6363 | — |
| 반응물 | 1,8-Diazabicyclo(5.4.0)undec-7-ene | HCID 81184 | — |
| 반응물 | 2-(dimethylamino)-4-(trifluoromethyl)-6H-1,3-oxazin-6-one | HCID 3723862 | — |
| 용매 | O-Xylene | HCID 7237 | — |
| 생성물 | 3-isopropyl-6-(trifluoromethyl)-2,4(1H,3H)-pyrimidinedione | HCID 11206812 | 54% |
반응 단계
Isopropylamine (1.2 g, 20.3 mmol) and 1,8-diazabicyclo[5,4,0]undec-7-ene (DBU, 6 mL) are added to a solution of 2-dimethylamino-4-trifluoromethyl-6H-1,3-oxazin-6-one (4.0 g, 19.2 mmol) in xylene (34 mL). The resultant reaction mixture is held at 100° C. for 3 hours, cooled, washed with 5 wt. % HCl (40 mL), and extracted with ethyl acetate. The combined organic extracts are concentrated and triturated with heptane. The solids are filtered and dried to give the title product as a yellow powder (2.3 g, 54% yield, mp 127°-129° C.) which is identified by 1H NMR (DMSO-d6) δ6.11 (1H, s), 4.96 (1H, sp), 1.35 (6H, d); and 19F NMR δ−68.9 (s).
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| 특허 번호 | US06355796B1 |
| 출처 데이터셋 | uspto-grants-2002_03 |
| ORD ID | ord-d1f2986d2ff44b47bd6a20692eb54ba4 |
| 출처 메모 | uspto-grants-2002_03 |