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

3-Bromopyridine → Tert-butyl 4-(pyridin-3-YL)piperazine-1-carboxylate

HRID 608
노트
인쇄 미리보기

반응식

HRID 608 반응식
Brc1cccnc1.CC(C)(C)OC(=O)N1CCNCC1>C1COCCO1.CC(=O)O.CC(=O)O.CC(C)(C)[O-].CC(C)Oc1cccc(OC(C)C)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.[Na+].[Pd]>CC(C)(C)OC(=O)N1CCN(c2cccnc2)CC1
참가 물질반응 조건실험 절차출처 및 근거반응 노트

참가 물질

7

반응물 2

HCID 122863-BromopyridineHCID 143452tert-Butyl piperazine-1-carboxylate

생성물 1

HCID 11673373Tert-butyl 4-(pyridin-3-YL)piperazine-1-carboxylate수율 37.96%

시약·촉매·용매 4

HCID 23676156Sodium t-butoxide시약HCID 4144353Palladium (II) acetate촉매

반응 조건

온도
100 °C

실험 절차

diacetoxypalladium (0.072 g, 0.32 mmol) and RuPhos (0.301 g, 0.64 mmol) were stirred in 1,4-dioxane (11.36 ml) for 10 mins at 50 °C.tert-butyl piperazine-1-carboxylate (0.6 g, 3.22 mmol), 3-bromopyridine (0.310 ml, 3.22 mmol) and sodium tert-butoxide (0.464 g, 4.83 mmol) were added and the reaction mixture was stirred at 100 °C for 64 h. The reaction mixture was filtered through celite. The crude product was purified by flash silica chromatography, elution gradient 20 to 100% EtOAc in heptane. Pure fractions were evaporated to dryness to afford tert-butyl 4-(pyridin-3-yl)piperazine-1-carboxylate (0.322 g, 38.0 %) as a yellow oil which crystallised on standing. This was then combined with EN06111-39-01.

출처 및 근거

ORD 기록
ord-c9d3e32c4ae3434fab0938e5982b9ebd
출처 데이터셋
750 AstraZeneca ELN dataset
원본 링크
출처 보기

반응 노트

불러오는 중…

이 페이지에서참가 물질반응 조건실험 절차출처 및 근거반응 노트
HCID 16217985
2-Dicyclohexylphosphino-2',6'-diisopropoxybiphenyl
촉매
HCID 312751,4-Dioxane용매