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Cesium carbonate → 7-Methyl-6-(methyloxy)-2H-1,4-benzoxazin-3(4H)-one

HRID 2114357
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Druckvorschau

Reaktionsgleichung

Reaktionsgleichung von HRID 2114357
[NH2:1][C:2]1[CH:7]=[C:6]([O:8][CH3:9])[C:5]([CH3:10])=[CH:4][C:3]=1[OH:11].C([O-])(O)=O.[Na+].Br[CH2:18][C:19](Br)=[O:20].C([O-])([O-])=O.[Cs+].[Cs+]>C(Cl)(Cl)Cl.CCOC(C)=O.CN(C=O)C.O>[CH3:10][C:5]1[C:6]([O:8][CH3:9])=[CH:7][C:2]2[NH:1][C:19](=[O:20])[CH2:18][O:11][C:3]=2[CH:4]=1
KomponentenVersuchsvorschriftAufarbeitungQuellen und NachweiseNotizen zur Reaktion

Komponenten

9

Edukt 4

HCID 10796Cesium carbonateHCID 61147Bromoacetyl bromideHCID 516892Sodium BicarbonateHCID 130767582-Amino-4-methoxy-5-methylphenol

Produkt 1

HCID 574186657-Methyl-6-(methyloxy)-2H-1,4-benzoxazin-3(4H)-oneAusbeute 58 %

Reagenzien, Katalysatoren, Lösungsmittel 4

HCID 962
Water
Lösungsmittel
HCID 6212ChloroformLösungsmittel
HCID 6228DimethylformamideLösungsmittel
HCID 8857Ethyl AcetateLösungsmittel

Versuchsvorschrift

To a solution of 2-amino-5-methyl-4-(methyloxy)phenol (3.0 g, 19 mmol) in CHCl3 (100 mL) were added saturated NaHCO3 (60 mL) and bromoacetyl bromide (5.78 g, 28.5 mmol) sequentially. The reaction mixture was vigorously stirred for 2 hours at room temperature, diluted with EtOAc (300 mL), washed with H2O, brine, and dried (Na2SO4). The solvent was removed via rotovap to give a brown solid. This brown solid was dissolved in DMF (200 mL), Cs2CO3 (6.19 g, 19 mmol) was added, and the reaction mixture was heated at 80° C. for 3 h. It was then poured into cold water (300 mL) and extracted with EtOAc (3×250 mL). The organic extracts were combined, washed with water, brine, and dried (MgSO4). The solvent was removed via rotovap, and the residue was purified on silica gel, using 50% EtOAc-Hexane, to give the title compound (2.13 g, 58%) as a brown solid. MS (ES) m/e 194 [M+H]+.

Aufarbeitung

  1. washwashed with H2O, brine
  2. dry with materialdried (Na2SO4)
  3. customThe solvent was removed via rotovap
  4. customto give a brown solid
  5. temperaturethe reaction mixture was heated at 80° C. for 3 h
  6. extractionextracted with EtOAc (3×250 mL)
  7. washwashed with water, brine
  8. dry with materialdried (MgSO4)
  9. customThe solvent was removed via rotovap
  10. customthe residue was purified on silica gel

Quellen und Nachweise

ORD-Eintrag
ord-16c9df4343d74c1f9898308de105811f
Quelldatensatz
uspto-grants-2008_10
DOI
10.6084/m9.figshare.5104873.v1
Patentnummer
US07432258B2

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