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Hydrogen Peroxide → 2,2-Difluoro-1,3-benzodioxol-4-ol

HRID 527657
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Druckvorschau

Reaktionsgleichung

Reaktionsgleichung von HRID 527657
[F:1][C:2]1([F:11])[O:6][C:5]2[CH:7]=[CH:8][CH:9]=[CH:10][C:4]=2[O:3]1.[Li]C(CC)C.C[O:18]B(OC)OC.OO.[OH-].[Na+]>C1COCC1.C1CCCCC1>[F:11][C:2]1([F:1])[O:3][C:4]2[CH:10]=[CH:9][CH:8]=[C:7]([OH:18])[C:5]=2[O:6]1
KomponentenReaktionsbedingungenVersuchsvorschriftAufarbeitungQuellen und NachweiseNotizen zur Reaktion

Komponenten

8

Edukt 5

HCID 784Hydrogen PeroxideHCID 8470Trimethyl borateHCID 14798Sodium HydroxideHCID 741032,2-Difluoro-1,3-benzodioxoleHCID 178418400CID 53628100

Produkt 1

HCID 111165412,2-Difluoro-1,3-benzodioxol-4-olAusbeute 95,3 %

Reagenzien, Katalysatoren, Lösungsmittel

2
HCID 8028TetrahydrofuranLösungsmittelHCID 8078CyclohexaneLösungsmittel2×

Reaktionsbedingungen

Temperatur
-78 °C

Versuchsvorschrift

2,2-Difluoro-1,3-benzodioxole (320 mg, 2.05 mmol) was dissolved in THF (2.5 mL) and cyclohexane (1.2 mL) and the resulting solution cooled down to −78° C. sec-BuLi 2M solution in cyclohexane (1.025 ml, 2.05 mmol) was added drop wise and the reaction mixture stirred for 2 hours at −78° C. Trimethylborate (230 mg, 2.25 mmol) was added and the mixture was allowed to warm slowly to room temperature. A 30% w/w aqueous solution of H2O2 (4.1 mmol) and NaOH (82 mg, 2.05 mmol) were added and the reaction mixture stirred for 18 hours at room temperature. The reaction was quenched with a 2N aqueous solution of HCl and diluted with ethyl acetate. Two phases were separated and the organic layer was washed twice with brine, dried over Na2SO4 and evaporated to dryness, affording the title compound (340 mg).

Aufarbeitung

  1. additionwas added drop wise
  2. temperatureto warm slowly to room temperature
  3. stirringthe reaction mixture stirred for 18 hours at room temperature
  4. customThe reaction was quenched with a 2N aqueous solution of HCl
  5. additiondiluted with ethyl acetate
  6. customTwo phases were separated
  7. washthe organic layer was washed twice with brine
  8. dry with materialdried over Na2SO4
  9. customevaporated to dryness

Quellen und Nachweise

ORD-Eintrag
ord-83b7b301ea65407dbc620c3fc0d63a85
Quelldatensatz
uspto-grants-2016_05
DOI
10.6084/m9.figshare.5104873.v1
Patentnummer
US09346790B2

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