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

Diethyl Ether → Ethyl 3-mercapto-4-oxopentanoate

HRID 1748808
노트
인쇄 미리보기

반응식

HRID 1748808 반응식
O.[SH2:2].[Na].Br[CH:5]([C:12](=[O:14])[CH3:13])[CH2:6][C:7]([O:9][CH2:10][CH3:11])=[O:8].CCOCC>O>[SH:2][CH:5]([C:12](=[O:14])[CH3:13])[CH2:6][C:7]([O:9][CH2:10][CH3:11])=[O:8]
참가 물질반응 조건실험 절차후처리출처 및 근거반응 노트

참가 물질

5

반응물 3

HCID 3283Diethyl EtherHCID 12933940Ethyl 3-bromo-4-oxopentanoateHCID 53442613Sodium hydrogen sulfide hydrate

생성물 1

HCID 86724137Ethyl 3-mercapto-4-oxopentanoate수율 58.4%

시약·촉매·용매 1

HCID 962Water용매

반응 조건

온도
0 °C

실험 절차

A round bottom flask was charged with sodium hydrogensulfide hydrate (1.23 g, 16.9 mmol) in water (14.2 mL). The solution was cooled to about 0° C. followed by the addition of ethyl 3-bromo-4-oxopentanoate (3.79 g, 16.9 mmol) dropwise over about 30 min. The mixture was stirred at about 0° C. for about 3 h. To the reaction mixture was added Et2O (40 mL) and the reaction was warmed to ambient temperature. The crude product was partitioned between Et2O (15 mL) and water (15 mL). The layers were separated and the aqueous layer was back extracted with Et2O (10 mL). The combined organic layers were dried over MgSO4, filtered and concentrated under reduced pressure to afford ethyl 3-mercapto-4-oxopentanoate (1.74 g, 9.87 mmol, 58%, which was used without further purification). LC-MS (Table 1, Method g) Rt=2.24 min, m/z 177 (M+H)+.

후처리

  1. temperaturethe reaction was warmed to ambient temperature
  2. customThe crude product was partitioned between Et2O (15 mL) and water (15 mL)
  3. customThe layers were separated
  4. extractionthe aqueous layer was back extracted with Et2O (10 mL)
  5. dry with materialThe combined organic layers were dried over MgSO4
  6. filtrationfiltered
  7. concentrationconcentrated under reduced pressure

출처 및 근거

ORD 기록
ord-6b69e2e75d2542eb8b353965aa24e8ac
출처 데이터셋
uspto-grants-2015_10
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US09150592B2

반응 노트

불러오는 중…

이 페이지에서참가 물질반응 조건실험 절차후처리출처 및 근거반응 노트