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Lithium Hydroxide → 3-Nitro-4-(piperidin-1-yl)benzoic acid

HRID 1950799
Notizen
Druckvorschau

Reaktionsgleichung

Reaktionsgleichung von HRID 1950799
F[C:2]1[CH:12]=[CH:11][C:5]([C:6]([O:8]CC)=[O:7])=[CH:4][C:3]=1[N+:13]([O-:15])=[O:14].[NH:16]1[CH2:21][CH2:20][CH2:19][CH2:18][CH2:17]1.[OH-].[Li+]>CN(C=O)C.O.C1COCC1>[N+:13]([C:3]1[CH:4]=[C:5]([CH:11]=[CH:12][C:2]=1[N:16]1[CH2:21][CH2:20][CH2:19][CH2:18][CH2:17]1)[C:6]([OH:8])=[O:7])([O-:15])=[O:14]
KomponentenReaktionsbedingungenVersuchsvorschriftAufarbeitungQuellen und NachweiseNotizen zur Reaktion

Komponenten

7

Edukt 3

HCID 3939Lithium HydroxideHCID 8082PiperidineHCID 21277355Ethyl 4-fluoro-3-nitrobenzoate

Produkt 1

HCID 28797653-Nitro-4-(piperidin-1-yl)benzoic acidAusbeute 96 %

Reagenzien, Katalysatoren, Lösungsmittel 3

HCID 962WaterLösungsmittel2×
HCID 6228
Dimethylformamide
Lösungsmittel
HCID 8028TetrahydrofuranLösungsmittel

Reaktionsbedingungen

Temperatur
50 °C

Versuchsvorschrift

A mixture of ethyl 4-fluoro-3-nitrobenzoate (Chontech 01072; 500 mg; 2.35 mmol; 1 eq.) and piperidine (Fluka 80640; 599.18 mg; 7.04 mmol; 3 eq.) in DMF (2 mL) was stirred at 50° C. for 3 hours. The reaction was then allowed to cool to room temperature and diluted with water. Extraction with ethyl acetate, drying over sodium sulfate and concentration in vacuo gave a yellow oil. The oil was taken up in THF (15 mL) and lithium hydroxide (280.86 mg; 11.73 mmol; 5 eq.) was added, followed by water (15 mL). The reaction mixture was then stirred at room temperature for 5 hours. THF was evaporated and the residue diluted with water. The aqueous phase was washed with Et2O and acidified to pH 5 with acetic acid. Extraction with Et2O followed by drying over magnesium sulfate and concentration in vacuo afforded the title compound (562 mg, 96%) as a yellow solid.

Aufarbeitung

  1. temperatureto cool to room temperature
  2. extractionExtraction with ethyl acetate
  3. dry with materialdrying over sodium sulfate and concentration in vacuo
  4. customgave a yellow oil
  5. stirringThe reaction mixture was then stirred at room temperature for 5 hours
  6. customTHF was evaporated
  7. additionthe residue diluted with water
  8. washThe aqueous phase was washed with Et2O
  9. extractionExtraction with Et2O
  10. dry with materialby drying over magnesium sulfate and concentration in vacuo

Quellen und Nachweise

ORD-Eintrag
ord-623a5736b1204300926b96e0912bb6b1
Quelldatensatz
uspto-grants-2013_03
DOI
10.6084/m9.figshare.5104873.v1
Patentnummer
US08404676B2

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