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Lithium Hydroxide → N-(2,4-dimethylphenyl)-4-[(2-hydroxyethyl)oxy]-N-(2-methylpropyl)benzenesulfonamide

HRID 1487026
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HRID 1487026 반응식
[CH3:1][C:2]1[CH:7]=[C:6]([CH3:8])[CH:5]=[CH:4][C:3]=1[NH:9][CH2:10][CH:11]([CH3:13])[CH3:12].C([O:18][CH2:19][CH2:20][O:21][C:22]1[CH:27]=[CH:26][C:25]([S:28](Cl)(=[O:30])=[O:29])=[CH:24][CH:23]=1)(=O)C=C.[OH-].[Li+]>N1C=CC=CC=1.CO.O1CCCC1.O>[CH3:1][C:2]1[CH:7]=[C:6]([CH3:8])[CH:5]=[CH:4][C:3]=1[N:9]([CH2:10][CH:11]([CH3:13])[CH3:12])[S:28]([C:25]1[CH:24]=[CH:23][C:22]([O:21][CH2:20][CH2:19][OH:18])=[CH:27][CH:26]=1)(=[O:30])=[O:29]
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참가 물질

8

반응물 3

HCID 3939Lithium HydroxideHCID 284223892,4-dimethyl-N-(2-methylpropyl)anilineHCID 898762902-{[4-(Chlorosulfonyl)phenyl]oxy}ethyl 2-propenoate

생성물 1

HCID 89875842N-(2,4-dimethylphenyl)-4-[(2-hydroxyethyl)oxy]-N-(2-methylpropyl)benzenesulfonamide

시약·촉매·용매 4

HCID 887Methanol용매
HCID 962
Water
용매
HCID 1049Pyridine용매
HCID 8028Tetrahydrofuran용매

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온도
20 °C

실험 절차

To a solution of (2,4-dimethylphenyl)(2-methylpropyl)amine (0.2 g, 1.128 mmol) in pyridine (10 mL) stirred in air at room temperature, was added 2-{[4-(chlorosulfonyl)phenyl]oxy}-ethyl 2-propenoate (0.656 g, 1.128 mmol). The reaction mixture was stirred at 20° C. for 30 minutes to ensure dissolution and then left to stand overnight. The pyridine was evaporated in vacuo (biotage V10) to give a residue. This was partially dissolved in methanol and applied to a pre-conditioned aminopropyl (NH2) solid phase extraction (SPE) cartridge eluting with additional methanol. The methanol fraction was then passed down a sulfonic acid (SCX) SPE cartridge again eluting with methanol. Solvent was evaporated in vacuo and the sample loaded in methanol and purified by reverse phase (C18) chromatography. The appropriate fractions were combined and dried under a stream of nitrogen to give the intermediate product. This was then taken up in tetrahydrofuran (THF) (1 mL) and lithium hydroxide (0.027 g, 1.128 mmol) in water (1 mL) was added. The mixture was stirred for 2 hours and then evaporated under a stream of nitrogen to give a residue. This was partitioned between water and dichloromethane and separated with a hydrophobic frit. The organic solvent was evaporated in vacuo (Biotage v10) to give the deprotected product as a colourless oil, 44.8 mg. LCMS [LCMS1] Rt 1.23 min, m/z (ES+) 378 (M+H).

후처리

  1. dissolutiondissolution
  2. waitleft
  3. waitto stand overnight
  4. customThe pyridine was evaporated in vacuo (biotage V10)
  5. customto give a residue
  6. extractionapplied to a pre-conditioned aminopropyl (NH2) solid phase extraction (SPE) cartridge
  7. washeluting with additional methanol
  8. washagain eluting with methanol
  9. customSolvent was evaporated in vacuo
  10. custompurified by reverse phase (C18) chromatography
  11. customdried under a stream of nitrogen
  12. customto give the intermediate product
  13. stirringThe mixture was stirred for 2 hours
  14. customevaporated under a stream of nitrogen
  15. customto give a residue
  16. customThis was partitioned between water and dichloromethane
  17. customseparated with a hydrophobic frit
  18. customThe organic solvent was evaporated in vacuo (Biotage v10)

출처 및 근거

ORD 기록
ord-6aab4c7200b842a38125c5052872bba9
출처 데이터셋
uspto-grants-2016_08
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US09428452B2

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