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Sodium Hydroxide → 7-Bromo-2,3-dihydro-1,8-naphthyridin-4(1H)-one

HRID 659450
Notizen
Druckvorschau

Reaktionsgleichung

Reaktionsgleichung von HRID 659450
[Br:1][C:2]1[N:7]=[C:6]([NH:8][CH2:9][CH2:10][C:11]([OH:13])=O)[CH:5]=[CH:4][CH:3]=1.CS(O)(=O)=O.O=P12OP3(OP(OP(O3)(O1)=O)(=O)O2)=O.[OH-].[Na+]>>[Br:1][C:2]1[N:7]=[C:6]2[C:5]([C:11](=[O:13])[CH2:10][CH2:9][NH:8]2)=[CH:4][CH:3]=1
KomponentenReaktionsbedingungenVersuchsvorschriftAufarbeitungQuellen und NachweiseNotizen zur Reaktion

Komponenten

4

Edukt 3

HCID 14798Sodium HydroxideHCID 124403563-((6-Bromopyridin-2-yl)amino)propanoic acid2×HCID 86584057Phosphorus Pentoxide-Methanesulfonic Acid2×

Produkt 1

HCID 124403577-Bromo-2,3-dihydro-1,8-naphthyridin-4(1H)-oneAusbeute 34 %

Reaktionsbedingungen

Temperatur
75 °C

Versuchsvorschrift

3-(6-Bromo-pyridin-2-ylamino)propionic acid (5.0 g) was combined with Eaton's reagent (100 mL) in a ratio of 5 g 3-(6-bromo-pyridin-2-ylamino)propionic acid per 100 mL Eaton's reagent. The resulting mixture was heated at 75° C. for 2.5 hours. Ice cold water (50 mL) was added to the reaction mixture, followed by aqueous NaOH (50% w/w) to pH 12. The mixture was then extracted twice with ethyl acetate (200 mL) and the combined organic phases were dried over sodium sulfate, filtered, and concentrated under reduced pressure. The mixture was purified by silica gel chromatography using a gradient of 0-80% ethyl acetate/hexane as the eluting solvent to give the title compound as a yellow solid (34% yield). M.p. 196-197° C., LCMS: m/z=227.26 (M+H+), 1H-NMR (DMSO-d6, 400 MHz) δ 2.57 (t, J=7.2 Hz, 2H), 3.34-3.49 (m, 2H), 6.80 (d, J=8.0 Hz, 1H), 7.74 (d, J=8.0 Hz, 1H), 7.96 (bs, 1H).

Aufarbeitung

  1. extractionThe mixture was then extracted twice with ethyl acetate (200 mL)
  2. dry with materialthe combined organic phases were dried over sodium sulfate
  3. filtrationfiltered
  4. concentrationconcentrated under reduced pressure
  5. customThe mixture was purified by silica gel chromatography

Quellen und Nachweise

ORD-Eintrag
ord-95614d628f194ae8b9df8dc7ff96f8d9
Quelldatensatz
uspto-grants-2011_12
DOI
10.6084/m9.figshare.5104873.v1
Patentnummer
US08080561B2

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