Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
Hexane → 3-1H-indol-4-yl-1-{[4-(trifluoromethyl)phenyl]methyl}urea
참여 물질
| 역할 | 이름 | HCID | 투입량 |
|---|---|---|---|
| 반응물 | Hexane | HCID 8058 | — |
| 반응물 | 4-(Trifluoromethyl)benzylamine | HCID 76804 | — |
| 반응물 | 4-isocyanato-1H-indole | HCID 22032644 | — |
| 용매 | Tetrahydrofuran | HCID 8028 | — |
| 생성물 | 3-1H-indol-4-yl-1-{[4-(trifluoromethyl)phenyl]methyl}urea | HCID 10314759 | — |
반응 단계
The product of Example 80A (0.16 g, 1 mmol) in THF (3 mL) was treated with 4-(trifluoromethyl)benzylamine (0.19 g, 1.1 mmol) at ambient temperature. After stirring for 3 hours, hexane was added to the reaction mixture to precipitate the title compound as a solid. mp 178° C. 1H NMR (300 MHz, DMSO-d6) δ 4.43 (d, 2H), 6.53 (t, 1H), (6.98 (m, 3H), 7.26 (t, 1H), 7.57 (d, 2H), 7.62 (d, 1H), 7.71 (d, 2H), 8.37 (s, 1H), 11.04 (s, 1H); MS (DCI+) m/z 334 (M+H); Anal. Calcd. For C17H14N3F3O: C, 61.26; H, 4.23; N, 12.61. Found: C, 61.28, H, 3.83; N, 12.31.
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| 특허 번호 | US06933311B2 |
| 출처 데이터셋 | uspto-grants-2005_08 |
| ORD ID | ord-22ef285b60f145908b821e2559935ae5 |
| 출처 메모 | uspto-grants-2005_08 |