홈MCP워크벤치Skills
홈워크벤치알림마이페이지
llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
  1. 홈
  2. /반응

5-Hexyl-3-isopropyl-3(3-nitrophenyl)-3a,6a-dihydropyrrolo(3,4-c)pyrazole-4,6(3H,5H) dione → 3-Hexyl-6-isopropyl-6-(3-nitrophenyl)-3-azabicyclo[3.1.0]hexane-2,4-dione

HRID 1826449
노트
인쇄 미리보기

반응식

HRID 1826449 반응식
[CH2:1]([N:7]1[C:14](=[O:15])[CH:13]2[CH:9](N=N[C:12]2([CH:25]([CH3:27])[CH3:26])[C:16]2[CH:21]=[CH:20][CH:19]=[C:18]([N+:22]([O-:24])=[O:23])[CH:17]=2)[C:8]1=[O:28])[CH2:2][CH2:3][CH2:4][CH2:5][CH3:6]>O1CCOCC1>[CH2:1]([N:7]1[C:14](=[O:15])[CH:13]2[CH:9]([C:12]2([CH:25]([CH3:27])[CH3:26])[C:16]2[CH:21]=[CH:20][CH:19]=[C:18]([N+:22]([O-:24])=[O:23])[CH:17]=2)[C:8]1=[O:28])[CH2:2][CH2:3][CH2:4][CH2:5][CH3:6]
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

3

반응물 1

HCID 221412935-Hexyl-3-isopropyl-3(3-nitrophenyl)-3a,6a-dihydropyrrolo(3,4-c)pyrazole-4,6(3H,5H) dione

생성물 1

HCID 221412793-Hexyl-6-isopropyl-6-(3-nitrophenyl)-3-azabicyclo[3.1.0]hexane-2,4-dione수율 104.6%

시약·촉매·용매 1

HCID 312751,4-Dioxane용매

실험 절차

5-Hexyl-3-isopropyl-3(3-nitrophenyl)-3a,6a-dihydropyrrolo(3,4-c)pyrazole-4,6(3H,5H)-dione (Preparation 58, 0.65 g, 1.6 mmol) was dissolved in dioxan (25 ml) and heated under reflux for 3 h. The solvent was removed in vacuo and the oily residue dried in vacuum for 16 h at room temperature to give the crude product as a yellow solid. The crude product was purified by chromatography on a Biotage Flash 12™ cartridge packed with silica gel (8 g), eluting with hexane:ethyl acetate (9:1) to give the title compound (0.60 g, 100%).

후처리

  1. temperatureheated
  2. temperatureunder reflux for 3 h
  3. customThe solvent was removed in vacuo
  4. customthe oily residue dried in vacuum for 16 h at room temperature
  5. customto give the crude product as a yellow solid
  6. customThe crude product was purified by chromatography on a Biotage Flash 12™ cartridge
  7. washeluting with hexane:ethyl acetate (9:1)

출처 및 근거

ORD 기록
ord-a4d505dd122b432f992e2e26aa7c178e
출처 데이터셋
uspto-grants-2006_05
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US07049444B2

반응 노트

불러오는 중…

이 페이지에서참가 물질실험 절차후처리출처 및 근거반응 노트