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Hydrochloric Acid → 2'-Methyl-2-oxo-1,2-dihydro-3,4'-bipyridine-6-carboxylic acid, hydrochloride salt

HRID 2364968
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HRID 2364968 반응식
Br[C:2]1[CH:3]=[CH:4][C:5]([C:10]([O:12]C)=[O:11])=[N:6][C:7]=1[O:8]C.Br[C:15]1[CH:16]=[CH:17][C:18]([C:23](=N)OC)=[N:19][C:20]=1OC.[ClH:27]>CO>[ClH:27].[CH3:23][C:18]1[CH:17]=[C:16]([C:2]2[C:7](=[O:8])[NH:6][C:5]([C:10]([OH:12])=[O:11])=[CH:4][CH:3]=2)[CH:15]=[CH:20][N:19]=1
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참가 물질

5

반응물 3

HCID 313Hydrochloric AcidHCID 46311222Methyl 5-bromo-6-methoxypicolinateHCID 68380252Methyl 5-bromo-6-methoxypyridine-2-carboximidoate

생성물 1

HCID 1317313152'-Methyl-2-oxo-1,2-dihydro-3,4'-bipyridine-6-carboxylic acid, hydrochloride salt

시약·촉매·용매 1

HCID 887Methanol용매

실험 절차

Synthesis of methyl 5-bromo-6-methoxypyridine-2-carboxylate (C30). A stirred solution of methyl 5-bromo-6-methoxypyridine-2-carboximidoate (C29) (9.42 g, 38.4 mmol) in methanol (66 mL) and concentrated hydrochloric acid (6.6 mL) was heated under reflux for 18 hours. The reaction was concentrated to dryness under reduced pressure. The resulting solid was dissolved in dichloromethane (500 mL) and washed with saturated aqueous sodium bicarbonate solution (250 mL). The aqueous phase was extracted with dichloromethane (200 mL), and the combined organics were washed with water (250 mL), with saturated aqueous sodium chloride solution (250 mL), dried over magnesium sulfate and concentrated under reduced pressure to provide the title compound. The reaction was repeated on additional material (1.65 g, 6.73 mmol), worked up in a similar manner, combined with the first reaction, and purified by silica gel chromatography (Eluant: 10% ethyl acetate in heptane) to provide the title compound as a yellow solid. Yield: 4.48 g, 18.2 mmol, 40%. LCMS m/z 246.1 (M+1). 1H NMR (400 MHz, CDCl3) δ 3.97 (s, 3H), 4.11 (s, 3H), 7.59 (d, J=7.8 Hz, 1H), 7.93 (d, J=7.8 Hz, 1H).

후처리

  1. temperatureunder reflux for 18 hours
  2. concentrationThe reaction was concentrated to dryness under reduced pressure
  3. dissolutionThe resulting solid was dissolved in dichloromethane (500 mL)
  4. washwashed with saturated aqueous sodium bicarbonate solution (250 mL)
  5. extractionThe aqueous phase was extracted with dichloromethane (200 mL)
  6. washthe combined organics were washed with water (250 mL), with saturated aqueous sodium chloride solution (250 mL)
  7. dry with materialdried over magnesium sulfate
  8. concentrationconcentrated under reduced pressure

출처 및 근거

ORD 기록
ord-d8bef0c1209947b2aabb14ddae4fd322
출처 데이터셋
uspto-grants-2014_04
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08697673B2

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