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

Methanesulfonyl chloride → HCID 21993950, 화합물

HRID 1978369
노트
인쇄 미리보기

반응식

HRID 1978369 반응식
[C:1]([S:4][CH2:5][P:6]([O:11][CH2:12][CH3:13])([O:8][CH2:9][CH3:10])=[O:7])(=O)[CH3:2].C[O-].[Na+].CO.S(OCC1[CH2:30][CH2:29][N:28]([C:31]([O:33][C:34]([CH3:37])([CH3:36])[CH3:35])=[O:32])[CH2:27][CH2:26]1)(C)(=O)=O.CS(Cl)(=O)=O.OCSCC1CCN(C(OC(C)(C)C)=O)CC1>CO.O1CCCC1.O.C(N(CC)CC)C>[CH2:9]([O:8][P:6]([CH2:5][S:4][CH2:1][CH:2]1[CH2:30][CH2:29][N:28]([C:31]([O:33][C:34]([CH3:36])([CH3:35])[CH3:37])=[O:32])[CH2:27][CH2:26]1)([O:11][CH2:12][CH3:13])=[O:7])[CH3:10]
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

10

반응물 5

HCID 31297Methanesulfonyl chlorideHCID 2765838Tert-butyl 4-(methylsulfonyloxymethyl)piperidine-1-carboxylateHCID 12536443S-[(Diethoxyphosphoryl)methyl] ethanethioateHCID 21993708HCID 21993708, 화합물HCID 23694274Sodium methanolate methanol

생성물 1

HCID 21993950HCID 21993950, 화합물

시약·촉매·용매 4

HCID 887Methanol용매HCID 962Water용매HCID 8028Tetrahydrofuran용매HCID 8471Triethylamine용매

실험 절차

To a solution of 1.529 g (6.759 mM) of S-(diethoxyphosphorylmethyl) thioacetate in 30 ml of methanol was added 1.30 g (6.76 mM) of 28% sodium methoxide-methanol under ice-cooling and the mixture was stirred at the prevailing temperature for 20 minutes. To this reaction mixture was added crude tert-butyl 4-(mesyloxymethyl)piperidine-1-carboxylate [which was prepared by adding 0.73 ml (9.46 mM) of methanesulfonyl chloride to a solution of 1.75 g (8.11 mM) of tert-butyl 4-(hydroxymethylthiomethyl)piperidine-1-carboxylate and 1.51 ml (10.8 mM) of triethylamine in 30 ml of tetrahydrofuran with ice-cooling, stirring the mixture at the prevailing temperature for 0.5 hour, pouring the mixture in water, extracting it with 2 portions of ethyl acetate, drying the pooled organic layer over MgSO4, and concentrating it], and the mixture was refluxed for 3 hours. The solvent was distilled off under reduced pressure and the residue was diluted with water and extracted with 2 portions of ethyl acetate. The organic layers were pooled and dried over MgSO4 and the solvent was distilled off under reduced pressure. The residue was purified by silica gel column chromatography (hexane-ethyl acetate: 3/1 to ethyl acetate) to provide the title compound.

후처리

  1. temperaturecooling
  2. customwas prepared
  3. temperaturecooling
  4. stirringstirring the mixture at the prevailing temperature for 0.5 hour
  5. extractionextracting it with 2 portions of ethyl acetate
  6. dry with materialdrying the pooled organic layer over MgSO4
  7. concentrationconcentrating it], and the mixture
  8. temperaturewas refluxed for 3 hours
  9. distillationThe solvent was distilled off under reduced pressure
  10. additionthe residue was diluted with water
  11. extractionextracted with 2 portions of ethyl acetate
  12. dry with materialdried over MgSO4
  13. distillationthe solvent was distilled off under reduced pressure
  14. customThe residue was purified by silica gel column chromatography (hexane-ethyl acetate: 3/1 to ethyl acetate)

출처 및 근거

ORD 기록
ord-cec811c9c7bf4f8eb76c5cd3130d7d9f
출처 데이터셋
uspto-grants-2001_05
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US06235731B1

반응 노트

불러오는 중…

이 페이지에서참가 물질실험 절차후처리출처 및 근거반응 노트