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Nitrogen → (2-Fluoro-4-methylphenyl)boronic acid

HRID 279064
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HRID 279064 반응식
N#N.Br[C:4]1[CH:9]=[CH:8][C:7]([CH3:10])=[CH:6][C:5]=1[F:11].C([Li])CCC.C([O:19][B:20](OCC)[O:21]CC)C>CCCCCC.O1CCCC1>[F:11][C:5]1[CH:6]=[C:7]([CH3:10])[CH:8]=[CH:9][C:4]=1[B:20]([OH:21])[OH:19]
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참가 물질

7

반응물 4

HCID 947NitrogenHCID 9009Triethyl borateHCID 5732804-Bromo-3-fluorotolueneHCID 178418339Butyllithium

생성물 1

HCID 2783132(2-Fluoro-4-methylphenyl)boronic acid

시약·촉매·용매 2

HCID 8028Tetrahydrofuran용매
HCID 8058
Hexane
용매

반응 조건

온도
-70 °C

실험 절차

To a 500 mL three-necked round-bottomed flask equipped with septum and N2 inlet were added 10.0 g (52.9 mmol) 4-bromo-3-fluorotoluene and 100 mL dry tetrahydrofuran. The solution was cooled to −70° C., and 25.4 mL (63.5 mmol) of a 2.5 M solution of butyl lithium in hexane was added slowly so the temperature did not exceed −60° C. The clear solution was stirred at −70° C. for 1 hour, then treated with 10.8 mL (63.5 mmol) triethylborate. The reaction was stirred for 2 hours at −70° C., then warmed to room temperature and stirred for 16 hours. The reaction was quenched with saturated aqueous ammonium chloride solution, adjusted to pH 1-2 with 1 N hydrochloric acid, and extracted with ethyl acetate. The organic layer was washed with brine, dried over sodium sulfate, and evaporated. The residue was triturated with hexane to a white solid, 6.1 g (75%), as a mixture of monoaryl and diaryl boronic acids.

후처리

  1. customdid not exceed −60° C
  2. stirringThe reaction was stirred for 2 hours at −70° C.
  3. temperaturewarmed to room temperature
  4. stirringstirred for 16 hours
  5. customThe reaction was quenched with saturated aqueous ammonium chloride solution
  6. extractionextracted with ethyl acetate
  7. washThe organic layer was washed with brine
  8. dry with materialdried over sodium sulfate
  9. customevaporated
  10. customThe residue was triturated with hexane to a white solid, 6.1 g (75%), as a mixture of monoaryl and diaryl boronic acids

출처 및 근거

ORD 기록
ord-3ce36dad2f7e49b88f501e441afa7a2a
출처 데이터셋
uspto-grants-2002_03
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US06362195B1

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