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

Ammonia → HCID 178477974, 화합물

HRID 885425
노트
인쇄 미리보기

반응식

HRID 885425 반응식
[Cl:1][C:2]1[CH:8]=[CH:7][CH:6]=[C:5]([N+:9]([O-])=O)[C:3]=1[NH2:4].N1[CH:17]=[CH:16][CH:15]=[CH:14]C=1.C1(C(Cl)=O)CC1.N>CC(N(C)C)=O.O.CO>[Cl:1][C:2]1[C:3]2[NH:4][C:14]([CH:15]3[CH2:17][CH2:16]3)=[N:9][C:5]=2[CH:6]=[CH:7][CH:8]=1
참가 물질반응 조건실험 절차후처리출처 및 근거반응 노트

참가 물질

8

반응물 4

HCID 222Ammonia2회HCID 1049PyridineHCID 698552-Chloro-6-nitroanilineHCID 77637Cyclopropanecarbonyl chloride

생성물 1

HCID 178477974HCID 178477974, 화합물수율 36%

시약·촉매·용매 3

HCID 887Methanol용매
HCID 962
Water
용매
2회
HCID 31374Dimethylacetamide용매

반응 조건

온도
50 °C

실험 절차

2-Chloro-6-nitroaniline (3.00 g, 17.4 mmol) and pyridine (7.0 mL, 86.9 mmol) were dissolved in DMA (17 mL), and the solution was added with cyclopropanecarbonylchloride (4.0 mL, 43.5), followed by stirring at 50° C. for 3 hr. Methanol (10 mL) and aqueous ammonia (9 mL) were added to the reaction mixture, and the mixture was stirred at room temperature for 30 min. Water (10 mL) was added, and the precipitated solid was collected by filtration. The solid was suspended in ethanol (38 mL) and water (38 mL) and the solution was added with ferrous sulfate 7 hydrate (13.86 g, 49.9 mmol) and aqueous ammonia (19 mL), followed by stirring at 50° C. for 4 hr. The reaction mixture was filtrated, and the filtrate was extracted with ethyl acetate, washed with brine, dried over anhydrous magnesium sulfate, and concentrated under reduced pressure. Acetic acid (8 mL) was added to the residue, and the mixture was stirred at 90° C. for 1 hr. The reaction mixture was concentrated under reduced pressure, and the residue was neutralized with aqueous sodium hydroxide solution, and the mixture was extracted with ethyl acetate. The organic layer was washed with brine, dried over anhydrous magnesium sulfate, and concentrated under reduced pressure. Ethyl acetate (5 mL) and diisopropyl ether (5 mL) were added to the residue and the precipitated solid was collected by filtration to give the title compound (1.20 g, 36%).

후처리

  1. stirringthe mixture was stirred at room temperature for 30 min
  2. filtrationthe precipitated solid was collected by filtration
  3. stirringby stirring at 50° C. for 4 hr
  4. filtrationThe reaction mixture was filtrated
  5. extractionthe filtrate was extracted with ethyl acetate
  6. washwashed with brine
  7. dry with materialdried over anhydrous magnesium sulfate
  8. concentrationconcentrated under reduced pressure
  9. additionAcetic acid (8 mL) was added to the residue
  10. stirringthe mixture was stirred at 90° C. for 1 hr
  11. concentrationThe reaction mixture was concentrated under reduced pressure
  12. extractionthe mixture was extracted with ethyl acetate
  13. washThe organic layer was washed with brine
  14. dry with materialdried over anhydrous magnesium sulfate
  15. concentrationconcentrated under reduced pressure
  16. additionEthyl acetate (5 mL) and diisopropyl ether (5 mL) were added to the residue
  17. filtrationthe precipitated solid was collected by filtration

출처 및 근거

ORD 기록
ord-3d76f6656bf24902a31e60f09e509334
출처 데이터셋
uspto-grants-2012_08
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08242151B2

반응 노트

불러오는 중…

이 페이지에서참가 물질반응 조건실험 절차후처리출처 및 근거반응 노트