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Diisobutylaluminum hydride → HCID 67233948, 화합물

HRID 339685
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HRID 339685 반응식
[Br:1][C:2]1[CH:3]=[C:4]([F:17])[CH:5]=[C:6]2[C:11]=1[N:10]=[C:9]([C:12](OCC)=[O:13])[CH:8]=[CH:7]2.CC(C[AlH]CC(C)C)C>C(Cl)Cl>[Br:1][C:2]1[CH:3]=[C:4]([F:17])[CH:5]=[C:6]2[C:11]=1[N:10]=[C:9]([CH2:12][OH:13])[CH:8]=[CH:7]2
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참가 물질

4

반응물 2

HCID 14487Diisobutylaluminum hydrideHCID 67234511HCID 67234511, 화합물

생성물 1

HCID 67233948HCID 67233948, 화합물

시약·촉매·용매 1

HCID 6344Dichloromethane용매

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온도
-78 °C

실험 절차

Ethyl 8-bromo-6-fluoroquinoline-2-carboxylate (3.201 g, 10.7 mmol) was weighed into a flask, and dissolved in 100 mL of DCM. The reaction was cooled to −78° C., followed by drop-wise addition of DIBAL-H (21.48 mL, 32.22 mmol) over 10 minutes. The reaction was then allowed to stir and warm to ambient temperature over 2 hours at which time the starting material had been consumed. The reaction was quenched with 10 mL MeOH, followed by addition of 100 mL of Rochelle's Salts, and stirred overnight to remove the emulsion. The reaction was then partitioned with ethyl acetate. The combined organic fractions were concentrated in vacuo. The crude semi solid was purified by flash column chromatography (eluting with a 20-50% ethyl acetate/hexanes gradient), affording the desired product as an orange-yellow semi solid (2.27 g, 42% yield) MS APCI (+) m/z 256.1 and 258 (M+1 of each Br isotope) detected.

후처리

  1. temperaturewarm to ambient temperature over 2 hours at which time the starting material
  2. customhad been consumed
  3. customThe reaction was quenched with 10 mL MeOH
  4. additionfollowed by addition of 100 mL of Rochelle's Salts
  5. stirringstirred overnight
  6. customto remove the emulsion
  7. customThe reaction was then partitioned with ethyl acetate
  8. concentrationThe combined organic fractions were concentrated in vacuo
  9. customThe crude semi solid was purified by flash column chromatography (
  10. washeluting with a 20-50% ethyl acetate/hexanes gradient),

출처 및 근거

ORD 기록
ord-db3cc271795947f880443cfb2afc68e5
출처 데이터셋
uspto-grants-2014_11
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08895550B2

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