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Hydrochloric Acid → 4-n-Octyloxyphenylboronic Acid (contains varying amounts of Anhydride)

HRID 525976
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HRID 525976 반응식
Br[C:2]1[CH:7]=[CH:6][C:5]([O:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH3:16])=[CH:4][CH:3]=1.C([Li])CCC.C([O:24][B:25](OCC)[O:26]CC)C.Cl>O1CCCC1>[CH2:9]([O:8][C:5]1[CH:6]=[CH:7][C:2]([B:25]([OH:26])[OH:24])=[CH:3][CH:4]=1)[CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH3:16]
참가 물질반응 조건실험 절차후처리출처 및 근거반응 노트

참가 물질

6

반응물 4

HCID 313Hydrochloric Acid2회HCID 9009Triethyl borateHCID 145298p-Bromophenyl octyl etherHCID 178418339Butyllithium

생성물 1

HCID 39772844-n-Octyloxyphenylboronic Acid (contains varying amounts of Anhydride)수율 55.8%

시약·촉매·용매 1

HCID 8028
Tetrahydrofuran
용매

반응 조건

온도
-78 °C

실험 절차

1-bromo-4-(octyloxy)benzene (14.64 g, 51.3 mmol) was dissolved in dry tetrahydrofuran in nitrogen atmosphere and cooled to −78° C. Butyllithium (50 ml, 80.0 mmol) was then added drop wise and the reaction mixture was let to room temperature. After an hour the mixture was once again cooled to −78° C. and triethylborate (23.6 g, 0.162 mol) was added drop wise. The reaction mixture was stirred over night at room temperature, acidified with 2M HCl, and the organic phase was recovered. It was washed once with water and three times with 1M sodium hydroxide to form a white soapy solid. The combined alkaline phases were acidified with 2M HCl and extracted with ether three times. The combined ether phases were washed with water and dried over magnesium sulphate. The product precipitated in dichloromethane from the reduced ether phase to yield 4-(octyloxy)phenylboronic acid (7.15 g, 28.6 mmol) as a white solid.

후처리

  1. customwas let to room temperature
  2. temperatureAfter an hour the mixture was once again cooled to −78° C.
  3. customthe organic phase was recovered
  4. washIt was washed once with water and three times with 1M sodium hydroxide
  5. customto form a white soapy solid
  6. extractionextracted with ether three times
  7. washThe combined ether phases were washed with water
  8. dry with materialdried over magnesium sulphate
  9. customThe product precipitated in dichloromethane from the reduced ether phase

출처 및 근거

ORD 기록
ord-be617dd875f04f31bf9d8631334c2454
출처 데이터셋
uspto-grants-2016_05
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US09343198B2

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