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

Sodium Azide → 1-(4-Bromophenyl)-1,2-dihydro-5H-tetrazol-5-one

HRID 1772616
노트
인쇄 미리보기

반응식

HRID 1772616 반응식
[Br:1][C:2]1[CH:7]=[CH:6][C:5]([N:8]=[C:9]=[O:10])=[CH:4][CH:3]=1.[N-:11]=[N+:12]=[N-:13].[Na+].[Cl-].[Cl-].[Cl-].[Al+3]>C1COCC1>[Br:1][C:2]1[CH:7]=[CH:6][C:5]([N:8]2[C:9](=[O:10])[NH:13][N:12]=[N:11]2)=[CH:4][CH:3]=1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

5

반응물 3

HCID 33557Sodium AzideHCID 756094-Bromophenyl isocyanateHCID 6451240Aluminum(III) Chloride

생성물 1

HCID 1362439061-(4-Bromophenyl)-1,2-dihydro-5H-tetrazol-5-one수율 73.5%

시약·촉매·용매 1

HCID 8028Tetrahydrofuran용매2회

실험 절차

To a solution of 1-bromo-4-isocyanatobenzene (5.00 g, 25.4 mmol) in THF (30 mL) was added sodium azide (5.00 g, 76.9 mmol) followed by the addition of a solution of aluminum trichloride (4.00 g, 30.3 mmol) in THF (18 mL) slowly. The reaction mixture was heated to reflux overnight. After cooling to rt, the reaction was quenched with H2O (50 mL). The organic solvent was removed under reduced pressure. The solids were collected by filtration to obtain compound 14a as a white solid (4.50 g, 71% yield). Mass Spectrum (LCMS, ESI pos.): Calcd. for C2H5BrN4O: 241.0 (M+H). Found 241.1.

이 페이지에서참가 물질실험 절차후처리출처 및 근거반응 노트

후처리

  1. temperatureThe reaction mixture was heated
  2. temperatureto reflux overnight
  3. customthe reaction was quenched with H2O (50 mL)
  4. customThe organic solvent was removed under reduced pressure
  5. filtrationThe solids were collected by filtration

출처 및 근거

ORD 기록
ord-43de58c07c3444d089f086aa8cbe8ac2
출처 데이터셋
uspto-grants-2016_02
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US09249163B2

반응 노트

불러오는 중…