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Methanol → (3-Bromo-5-fluorophenyl)methanol

HRID 595981
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HRID 595981 반응식
[Br:1][C:2]1[CH:3]=[C:4]([CH:8]=[C:9]([F:11])[CH:10]=1)[C:5](O)=[O:6].B.C1COCC1.CO>C1COCC1>[Br:1][C:2]1[CH:3]=[C:4]([CH2:5][OH:6])[CH:8]=[C:9]([F:11])[CH:10]=1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

5

반응물 3

HCID 887MethanolHCID 2723981Borane;tetrahydrofuranHCID 27733393-Bromo-5-fluorobenzoic acid

생성물 1

HCID 2769402(3-Bromo-5-fluorophenyl)methanol

시약·촉매·용매 1

HCID 8028Tetrahydrofuran용매

실험 절차

To a suspension of 3-bromo-5-fluorobenzoic acid (4.51 g, 20.59 mmol) in THF (41.2 mL) at 0° C., BH3.THF (41.2 mL, 41.2 mmol) was added dropwise over 30 min, the reaction mixture was then allowed to return to room temperature and stirred at room temperature overnight. Methanol (40 mL) was added slowly and stirred at room temperature for 1 h. THF and Methanol was removed in vacuo. The residue was then extracted by EtOAc, and washed with sat.NaHCO3, The organic was dried and concentrated. The crude product was used in next step reaction without purification. LCMS (m/z): 187.2 (MH+−18), 0.66 min. 1H NMR (400 MHz, CDCl3) δ ppm 7.32 (s, 1H), 7.19-7.14 (m, 1H), 7.05 (tdd, J=0.7, 1.5, 9.1 Hz, 1H), 4.70 (br. s., 2H), 1.78 (br. s., 1H).

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후처리

  1. customto return to room temperature
  2. stirringstirred at room temperature for 1 h
  3. customTHF and Methanol was removed in vacuo
  4. extractionThe residue was then extracted by EtOAc
  5. washwashed
  6. dry with materialNaHCO3, The organic was dried
  7. concentrationconcentrated
  8. customThe crude product was used in next step reaction without purification
  9. custom187.2 (MH+−18), 0.66 min

출처 및 근거

ORD 기록
ord-ce263cb54f1843f780e6e27dc29f5c26
출처 데이터셋
uspto-grants-2016_01
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US09242996B2

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