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Water → 3-Methyl-5-bromo-2-(4-fluoro-benzenesulfonylamino)-benzoic acid

HRID 1883531
Notizen
Druckvorschau

Reaktionsgleichung

Reaktionsgleichung von HRID 1883531
C[O:2][C:3](=[O:13])[C:4]1[CH:9]=[C:8]([Br:10])[CH:7]=[C:6]([CH3:11])[C:5]=1[NH2:12].[F:14][C:15]1[CH:20]=[CH:19][C:18]([S:21](Cl)(=[O:23])=[O:22])=[CH:17][CH:16]=1.O>N1C=CC=CC=1>[CH3:11][C:6]1[C:5]([NH:12][S:21]([C:18]2[CH:19]=[CH:20][C:15]([F:14])=[CH:16][CH:17]=2)(=[O:23])=[O:22])=[C:4]([CH:9]=[C:8]([Br:10])[CH:7]=1)[C:3]([OH:2])=[O:13]
KomponentenVersuchsvorschriftAufarbeitungQuellen und NachweiseNotizen zur Reaktion

Komponenten

5

Edukt 3

HCID 962WaterHCID 95884-Fluorobenzenesulfonyl chlorideHCID 2763413Methyl 2-amino-5-bromo-3-methylbenzoate

Produkt 1

HCID 215844933-Methyl-5-bromo-2-(4-fluoro-benzenesulfonylamino)-benzoic acidAusbeute 39 %

Reagenzien, Katalysatoren, Lösungsmittel 1

HCID 1049PyridineLösungsmittel

Versuchsvorschrift

To a solution of 25.0 g (0.102 mol) of 2-amino-3-methyl-5-bromobenzoic acid methyl ester (U.S. Pat. No. 5,776,961) in 300 mL of pyridine was added 21.93 g (0.113 mol) of 4-fluorobenzenesulfonyl chloride. The reaction mixture was stirred for 18 h at 80°, cooled to room temperature and poured into water. The resulting mixture was extracted with ethyl acetate and the combined organics were then washed with 5% HCl solution and water. The organic layer was then dried over MgSO4, filtered and concentrated in vacuo. The residue was chromatographed on silica gel eluting with ethyl acetate/hexanes (1:3) to provide 14.53 g (39%) of the desired product as a tan solid. Electrospray Mass Spec: 388.0 (M−H)−

Aufarbeitung

  1. extractionThe resulting mixture was extracted with ethyl acetate
  2. washthe combined organics were then washed with 5% HCl solution and water
  3. dry with materialThe organic layer was then dried over MgSO4
  4. filtrationfiltered
  5. concentrationconcentrated in vacuo
  6. customThe residue was chromatographed on silica gel eluting with ethyl acetate/hexanes (1:3)

Quellen und Nachweise

ORD-Eintrag
ord-989095f6fa1d467c9ee55125e96f22a1
Quelldatensatz
uspto-grants-2004_07
DOI
10.6084/m9.figshare.5104873.v1
Patentnummer
US06762178B2

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