Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
Hexane → N-(4-bromobenzyl)-N'-1H-indol-4-ylurea
참여 물질
| 역할 | 이름 | HCID | 투입량 |
|---|---|---|---|
| 반응물 | Hexane | HCID 8058 | — |
| 반응물 | 4-Aminoindole | HCID 583431 | — |
| 반응물 | 4-Bromobenzyl isocyanate | HCID 4374617 | — |
| 용매 | Tetrahydrofuran | HCID 8028 | — |
| 생성물 | N-(4-bromobenzyl)-N'-1H-indol-4-ylurea | HCID 10172204 | — |
반응 단계
4-aminoindole (0.13 g, 1 mmol) in THF (3 mL) was treated with 1-bromo-4-(isocyanatomethyl)benzene (0.23 g, 1.1 mmol) for 3 hours at ambient temperature. Hexane was added to the reaction mixture to precipitate 0.26 g of the title compound as a tan solid. mp 198° C.; 1H NMR (300 MHz, DMSO-d6) δ 4.30 (d, 2H), 6.51 (t, 1H), 6.89 (t, 1H), 6.95 (d, 2H), 7.29 (t, 1H), 7.31 (d, 2H), 7.55 (d, 2H), 7.62 (dd, 1H), 8.3 (s, 1H), 11.04 (s, 1H); MS (DCI+) m/z 346 (M+H); Anal. Calcd. For C16H14N3BrO: C, 55.83; H, 4.10; N, 12.21. Found: C, 55.71, H, 4.12; N, 12.01.
출처 및 근거
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| 특허 번호 | US07074805B2 |
| 출처 데이터셋 | uspto-grants-2006_07 |
| ORD ID | ord-2ab03b67d609402ea896932a96ef91f3 |
| 출처 메모 | uspto-grants-2006_07 |