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

Water → HCID 67797455, 화합물

HRID 1657252
노트
인쇄 미리보기

반응식

HRID 1657252 반응식
O.[C:2]([S:6]([CH2:8][CH:9]([CH2:15][C:16]1[CH:21]=[CH:20][CH:19]=[CH:18][CH:17]=1)[C:10]([O:12]CC)=[O:11])=[O:7])([CH3:5])([CH3:4])[CH3:3].[OH-].[Ca+2].[OH-]>CS(C)=O>[C:2]([S:6]([CH2:8][C@@H:9]([CH2:15][C:16]1[CH:17]=[CH:18][CH:19]=[CH:20][CH:21]=1)[C:10]([OH:12])=[O:11])=[O:7])([CH3:5])([CH3:3])[CH3:4]
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

5

반응물 3

HCID 962WaterHCID 6093208Calcium HydroxideHCID 14158063HCID 14158063, 화합물

생성물 1

HCID 67797455HCID 67797455, 화합물수율 56.9%

시약·촉매·용매 1

HCID 679Dimethyl Sulfoxide용매

실험 절차

550 ml of water are placed in a sulphonation flask having a mechanical stirrer, pH control as well as a dropping funnel and treated while stirring vigorously with 4.85 g (16.36 mmol) of ethyl (RS)-α-[[(RS)-t-butylsulphinyl]methyl]hydrocinnamate (see EPA 0 236 734) in 15 ml of dimethyl sulphoxide. The reaction solution is thereafter adjusted to pH 7.5, treated with 200 mg of α-chymotrypsin and the pH is held constant with 0.037N calcium hydroxide solution. After 220 ml of this calcium hydroxide solution have been consumed (about 45 hours) the unreacted ester is extracted with ethyl acetate, the aqueous phase is adjusted to pH 2 with 30% sulphuric acid and extracted with ethyl acetate. The extracts are washed in succession with water and saturated sodium chloride solution, dried over magnesium sulphate and evaporated, whereby there are obtained 2.50 g of (S)-α-[[(RS)-t-butylsulphinyl]methyl]hydrocinnamic acid, MS: 269 (M+H)+.

후처리

  1. additionpH control as well as a dropping funnel and treated
  2. additiontreated with 200 mg of α-chymotrypsin
  3. customAfter 220 ml of this calcium hydroxide solution have been consumed (about 45 hours) the unreacted ester
  4. extractionis extracted with ethyl acetate
  5. extractionextracted with ethyl acetate
  6. washThe extracts are washed in succession with water and saturated sodium chloride solution
  7. dry with materialdried over magnesium sulphate
  8. customevaporated

출처 및 근거

ORD 기록
ord-71ee02aca6684208b78298e8adb06b65
출처 데이터셋
uspto-grants-1993_10
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US05256645

반응 노트

불러오는 중…

이 페이지에서참가 물질실험 절차후처리출처 및 근거반응 노트