StartseiteMCPWorkbenchSkills
StartseiteWorkbenchBenachrichtigungenMein Bereich
llms.txt · MCP-AnleitungDatenschutz · Nutzungsbedingungen · Supportv1.8.0
  1. Startseite
  2. /Reaktion

Potassium Carbonate → 4-[(Pyridin-2-yl)sulfanyl]aniline

HRID 2110071
Notizen
Druckvorschau

Reaktionsgleichung

Reaktionsgleichung von HRID 2110071
FC(F)(F)[C:3]1[CH:4]=[C:5]([N+:16]([O-])=O)[CH:6]=[CH:7][C:8]=1[S:9][C:10]1[CH:15]=[CH:14]N=CC=1.SC1C=C[N:25]=[CH:24][CH:23]=1.FC1C=CC([N+]([O-])=O)=CC=1C(F)(F)F.C(=O)([O-])[O-].[K+].[K+]>CN(C=O)C.CCOCC.O>[N:25]1[CH:24]=[CH:23][CH:14]=[CH:15][C:10]=1[S:9][C:8]1[CH:3]=[CH:4][C:5]([NH2:16])=[CH:6][CH:7]=1
KomponentenVersuchsvorschriftAufarbeitungQuellen und NachweiseNotizen zur Reaktion

Komponenten

8

Edukt 4

HCID 11430Potassium CarbonateHCID 949542-Fluoro-5-nitrobenzotrifluorideHCID 230230843-Trifluoromethyl-4-(4-pyridinylthio)nitrobenzeneHCID 178418431pyridine-4-thiol

Produkt 1

HCID 189716604-[(Pyridin-2-yl)sulfanyl]anilineAusbeute 54 %

Reagenzien, Katalysatoren, Lösungsmittel 3

HCID 962
Water
Lösungsmittel
HCID 3283Diethyl EtherLösungsmittel
HCID 6228DimethylformamideLösungsmittel

Versuchsvorschrift

3-(Trifluoromethyl)-4-(4-pyridinylthio)nitrobenzene: A solution of 4-mercaptopyridine (2.8 g, 24 mmoles), 2-fluoro-5-nitrobenzotrifluoride (5 g, 23.5 mmoles), and potassium carbonate (6.1 g, 44.3 mmoles) in anhydrous DMF (80 mL) was stirred at room temperature and under argon overnight. TLC showed complete reaction. The mixture was diluted with Et2O (100 mL) and water (100 mL) and the aqueous layer was back-extracted with Et2O (2×100 mL). The organic layers were washed with a saturated NaCl solution (100 mL), dried (MgSO4), and concentrated under reduced pressure. The solid residue was triturated with Et2O to afford the desired product as a tan solid (3.8 g, 54%): TLC (30% EtOAc/70% hexane) Rf 0.06; 1H-NMR (DMSO-d6) δ 7.33 (dd, J=1.2, 4.2 Hz, 2H), 7.78 (d, J=8.7 Hz, 1H), 8.46 (dd, J=2.4, 8.7 Hz, 1H), 8.54-8.56 (m, 3H).

Aufarbeitung

  1. customreaction
  2. extractionthe aqueous layer was back-extracted with Et2O (2×100 mL)
  3. washThe organic layers were washed with a saturated NaCl solution (100 mL)
  4. dry with materialdried (MgSO4)
  5. concentrationconcentrated under reduced pressure
  6. customThe solid residue was triturated with Et2O

Quellen und Nachweise

ORD-Eintrag
ord-29f9c0902d4f4c4e87c161f34f83146b
Quelldatensatz
uspto-grants-2009_04
DOI
10.6084/m9.figshare.5104873.v1
Patentnummer
US07517880B2

Notizen zur Reaktion

Wird geladen…

Auf dieser SeiteKomponentenVersuchsvorschriftAufarbeitungQuellen und NachweiseNotizen zur Reaktion