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

Nitrogen → [4-(Chloromethyl)-1,3-thiazol-2-yl]methanol

HRID 42793
노트
인쇄 미리보기

반응식

HRID 42793 반응식
N#N.C([O:5][C:6]([C:8]1[S:9][CH:10]=[C:11]([CH2:13][Cl:14])[N:12]=1)=O)C.CC(C[AlH]CC(C)C)C.[C@H](O)(C([O-])=O)[C@@H](O)C([O-])=O.[Na+].[K+]>C1COCC1>[Cl:14][CH2:13][C:11]1[N:12]=[C:8]([CH2:6][OH:5])[S:9][CH:10]=1
참가 물질반응 조건실험 절차후처리출처 및 근거반응 노트

참가 물질

6

반응물 4

HCID 947NitrogenHCID 9357Potassium Sodium TartrateHCID 14487Diisobutylaluminum hydrideHCID 10822129Ethyl 4-(chloromethyl)-1,3-thiazole-2-carboxylate

생성물 1

HCID 11073749[4-(Chloromethyl)-1,3-thiazol-2-yl]methanol

시약·촉매·용매 1

HCID 8028Tetrahydrofuran
용매
2회

반응 조건

온도
-78 °C

실험 절차

In a flame dried round-bottomed flask equipped with a magnetic stir bar and under inert atmosphere (N2), a solution of 4-chloromethyl-thiazole-2-carboxylic acid ethyl ester (2.47 g, 12.03 mmol) in THF (120.0 mL) was treated at −78° C. with DiBAL (36.09 mL of a 1M sol in THF, 36.09 mmol) and the reaction mixture was stirred for 1 h at −78° C. and the allowed to warm to rt over 1 h. The reaction mixture was poured over a sat. aq. Rochelle's salt sol. and stirred for 1 h at rt. The aq. layer was extracted with EtOAc (2×150 mL) and the combined org. layer was washed with brine (200 mL). The organic layer was dried over MgSO4, filtered, and the solvent removed under reduced pressure. Purification of the residue by FC (1:1 hept-EA) gave the title compound as a light yellow oil. TLC:rf (1:1 hept-EA)=0.30. LC-MS-conditions 02: tR=0.59 min, [M+H]+=164.07.

후처리

  1. temperatureto warm to rt over 1 h
  2. stirringstirred for 1 h at rt
  3. extractionThe aq. layer was extracted with EtOAc (2×150 mL)
  4. washlayer was washed with brine (200 mL)
  5. dry with materialThe organic layer was dried over MgSO4
  6. filtrationfiltered
  7. customthe solvent removed under reduced pressure
  8. customPurification of the residue by FC (1:1 hept-EA)

출처 및 근거

ORD 기록
ord-39cb831c15c84561a45ac6c7c947f6fb
출처 데이터셋
uspto-grants-2013_09
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08536209B2

반응 노트

불러오는 중…

이 페이지에서참가 물질반응 조건실험 절차후처리출처 및 근거반응 노트