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

HCID 90423520, 화합물 → 3-(2H-tetrazol-5-yl)-5-(trifluoromethyl)aniline

HRID 1050189
노트
인쇄 미리보기

반응식

HRID 1050189 반응식
[N+:1]([C:4]1[CH:5]=[C:6]([C:14]2[N:15]=[N:16][NH:17][N:18]=2)[CH:7]=[C:8]([C:10]([F:13])([F:12])[F:11])[CH:9]=1)([O-])=O>CO.[Pd]>[N:18]1[NH:17][N:16]=[N:15][C:14]=1[C:6]1[CH:5]=[C:4]([CH:9]=[C:8]([C:10]([F:11])([F:12])[F:13])[CH:7]=1)[NH2:1]
참가 물질반응 조건실험 절차후처리출처 및 근거반응 노트

참가 물질

4

반응물 1

HCID 90423520HCID 90423520, 화합물

생성물 1

HCID 904233223-(2H-tetrazol-5-yl)-5-(trifluoromethyl)aniline수율 92%

시약·촉매·용매 2

HCID 23938Palladium촉매HCID 887Methanol용매

반응 조건

온도
20 °C

실험 절차

A mixture of 5-(3-nitro-5-(trifluoromethyl)phenyl)-2H-tetrazole (220 mg, 0.849 mmol) in MeOH (10 mL) was added Pd/C (45.2 mg, 0.424 mmol) under N2. The mixture was stirred at 20° C. under a H2 atmosphere for 1 h. LCMS showed the reaction was finished. The mixture was filtrated, and the filtrate was concentrated to give 3-(2H-tetrazol-5-yl)-5-(trifluoromethyl)aniline (200 mg, 0.781 mmol, 92% yield): 1H NMR (400 MHz, METHANOL-d4) δ 7.96 (s, 1H), 7.71 (s, 1H), 7.32 (s, 1H). ES-LCMS (m/z) 230 (M+H).

이 페이지에서참가 물질반응 조건실험 절차후처리출처 및 근거반응 노트

후처리

  1. filtrationThe mixture was filtrated
  2. concentrationthe filtrate was concentrated

출처 및 근거

ORD 기록
ord-749a7cadfc684a57a88d3e42d8827841
출처 데이터셋
uspto-grants-2016_07
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US09382238B2

반응 노트

불러오는 중…