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Tetrahydrofuran → 1-[2-(1-Methyl-1-hydroxyethyl)-3-fluorophenyl]isoquinoline

HRID 84135
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HRID 84135 반응식
[F:1][C:2]1[C:3](CC(O)=O)=[C:4]([C:8]2[C:17]3[C:12](=[CH:13][CH:14]=[CH:15][CH:16]=3)[CH:11]=[CH:10][N:9]=2)[CH:5]=[CH:6][CH:7]=1.[CH3:22][Li].[CH2:24]1[CH2:28][O:27]CC1>>[CH3:22][C:28]([C:3]1[C:2]([F:1])=[CH:7][CH:6]=[CH:5][C:4]=1[C:8]1[C:17]2[C:12](=[CH:13][CH:14]=[CH:15][CH:16]=2)[CH:11]=[CH:10][N:9]=1)([OH:27])[CH3:24]
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참가 물질

4

반응물 3

HCID 8028TetrahydrofuranHCID 672340361-[3-Fluoro-2-(carboxymethyl)phenyl]isoquinolineHCID 178418348HCID 178418348, 화합물

생성물 1

HCID 595226581-[2-(1-Methyl-1-hydroxyethyl)-3-fluorophenyl]isoquinoline

실험 절차

45.27 g (0.161 mol) of 1-[3-fluoro-2-(carboxymethyl)phenyl]isoquinoline were dissolved in 950 ml of THF and admixed dropwise at −78° C. with 185.12 ml (0.370 mol, 2.3 eq.) of methyllithium (2 M in diethyl ether). After the addition, the mixture was stirred at from −78° C. to −20° C. for 18 h. The reaction mixture was subsequently quenched with MeOH with ice cooling and admixed with 500 ml of dichloromethane. The mixture was subsequently washed three times with 100 ml of NaHCO3 solution and water, dried over MgSO4 and concentrated under reduced pressure. The resulting solid was crystallized from 600 ml of heptane. 29.72 g of a white solid were obtained, corresponding to 65.8% of theory, with a purity of 97.5%.

후처리

  1. additionAfter the addition
  2. customThe reaction mixture was subsequently quenched with MeOH with ice cooling
  3. washThe mixture was subsequently washed three times with 100 ml of NaHCO3 solution and water
  4. dry with materialdried over MgSO4
  5. concentrationconcentrated under reduced pressure
  6. customThe resulting solid was crystallized from 600 ml of heptane

출처 및 근거

ORD 기록
ord-3e34cfd9f7724b6785aee3d7d3d69e03
출처 데이터셋
uspto-grants-2014_09
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08846920B2

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