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Stannous chloride dihydrate → 5-Bromo-2-fluoro-4-methylaniline

HRID 83762
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Druckvorschau

Reaktionsgleichung

Reaktionsgleichung von HRID 83762
[Br:1][C:2]1[CH:7]=[C:6]([N+:8]([O-])=O)[C:5]([F:11])=[CH:4][C:3]=1[CH3:12].O.O.Cl[Sn]Cl.C([O-])(O)=O.[Na+]>C(O)C>[Br:1][C:2]1[C:3]([CH3:12])=[CH:4][C:5]([F:11])=[C:6]([CH:7]=1)[NH2:8]
KomponentenVersuchsvorschriftAufarbeitungQuellen und NachweiseNotizen zur Reaktion

Komponenten

5

Edukt 3

HCID 61436Stannous chloride dihydrateHCID 516892Sodium BicarbonateHCID 100369831-Bromo-4-fluoro-2-methyl-5-nitrobenzene

Produkt 1

HCID 467391145-Bromo-2-fluoro-4-methylanilineAusbeute 31,9 %

Reagenzien, Katalysatoren, Lösungsmittel 1

HCID 702EthanolLösungsmittel

Versuchsvorschrift

To a stirred solution of 1-bromo-4-fluoro-2-methyl-5-nitrobenzene (18.0 g) in ethanol (300 mL) was added SnCl2.2H2O (51.8 g, 0.230 mol) at room temperature. The mixture was heated at reflux for 3 h. The solvent was evaporated under reduced pressure to give a residue, which was poured into ice water. The aqueous phase was basified with sat. NaHCO3 to pH 7. The solid was filtered off and the filtrate was extracted with dichloromethane (200 mL×3). The combined organics were dried over anhydrous Na2SO4 and evaporated under reduced pressure. The residue was purified by column chromatography (petroleum ether/EtOAc=10/1) to afford 5-bromo-2-fluoro-4-methylaniline (5.0 g, 30% yield for two steps). 1H NMR (400 MHz, CDCl3) δ 6.96 (d, J=8.8 Hz, 1H), 6.86 (d, J=11.6 Hz, 1H), 3.64 (br, 2H), 2.26 (s, 3H). MS (ESI) m/z (M+H+) 204.0.

Aufarbeitung

  1. temperatureThe mixture was heated
  2. temperatureat reflux for 3 h
  3. customThe solvent was evaporated under reduced pressure
  4. customto give a residue, which
  5. filtrationThe solid was filtered off
  6. extractionthe filtrate was extracted with dichloromethane (200 mL×3)
  7. dry with materialThe combined organics were dried over anhydrous Na2SO4
  8. customevaporated under reduced pressure
  9. customThe residue was purified by column chromatography (petroleum ether/EtOAc=10/1)

Quellen und Nachweise

ORD-Eintrag
ord-19513205f7cb4b1292693125f4cd789d
Quelldatensatz
uspto-grants-2014_09
DOI
10.6084/m9.figshare.5104873.v1
Patentnummer
US08846753B2

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