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Dimethylformamide → 2,4-Difluoro-3-(hydroxymethyl)phenol

HRID 899244
Notes
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Reaction equation

HRID 899244 reaction equation
C([Si]([O:8][C:9]1[CH:14]=[CH:13][C:12]([F:15])=[CH:11][C:10]=1[F:16])(C)C)(C)(C)C.C([Li])CCC.CCCCCC.CN(C)[CH:30]=[O:31].[BH4-].[Na+]>O1CCCC1.CO>[F:16][C:10]1[C:11]([CH2:30][OH:31])=[C:12]([F:15])[CH:13]=[CH:14][C:9]=1[OH:8]
ParticipantsConditionsProcedureWorkupSources & evidenceReaction notes

Participants

8

Reactant 5

HCID 6228DimethylformamideHCID 8058HexaneHCID 4311764Sodium borohydrideHCID 14811687HCID 14811687, compoundHCID 178418339Butyllithium

Product 1

HCID 451191212,4-Difluoro-3-(hydroxymethyl)phenol

Reagents, catalysts & solvents 2

HCID 887
Methanol
Solvent
HCID 8028TetrahydrofuranSolvent

Conditions

Temperature
-78 °C

Procedure

To a stirred solution of tert-butyl(2,4-difluorophenoxy)dimethylsilane (J. Med. Chem. 1993, 36, 3947, 1.50 g, 6.14 mmol) in tetrahydrofuran (30 mL) was added a 1.57 M solution of n-butyllithium in hexane (4.69 mL, 7.37 mmol) at −78° C. over 10 minutes, and the mixture was stirred at −78° C. for 2 h. To the mixture, N,N-dimethylformamide (0.950 mL, 2.28 mmol) was added at −78° C. The mixture was stirred at −78° C. for 1 h, allowed to warm to room temperature and stand at room temperature for 16 h. The mixture was diluted with methanol (20 mL), and to the mixture was added sodium borohydride (696 mg, 18.4 mmol) at 0° C. The mixture was stirred at room temperature for 1.5 h. The reaction was quenched by addition of aqueous ammonium chloride at 0° C. to be pH=7. The mixture was extracted with diethyl ether (200 mL) and the organic layer washed with brine, dried over magnesium sulfate and evaporated. The residue was purified by column chromatography on silica gel (100 g) eluting with hexane/ethyl acetate (2/1) to afford 410 mg (42%) of the title as a colorless oil:

Workup

  1. stirringThe mixture was stirred at −78° C. for 1 h
  2. temperatureto warm to room temperature
  3. waitstand at room temperature for 16 h
  4. stirringThe mixture was stirred at room temperature for 1.5 h
  5. customThe reaction was quenched by addition of aqueous ammonium chloride at 0° C.
  6. extractionThe mixture was extracted with diethyl ether (200 mL)
  7. washthe organic layer washed with brine
  8. dry with materialdried over magnesium sulfate
  9. customevaporated
  10. customThe residue was purified by column chromatography on silica gel (100 g)
  11. washeluting with hexane/ethyl acetate (2/1)
  12. customto afford 410 mg (42%) of the title as a colorless oil

Sources & evidence

ORD record
ord-2be136926b9540868074aff0d572f222
Source dataset
uspto-grants-2008_04
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US07354925B2

Reaction notes

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On this pageParticipantsConditionsProcedureWorkupSources & evidenceReaction notes