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Ammonium Chloride → 2-[1-(6-Tert-butoxycarbonylamino-pyridin-3-yl)-propyl]-malonic acid diethyl ester

HRID 1789906
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HRID 1789906 반응식
[CH2:1]([Mg]Br)[CH3:2].[CH2:5]([O:7][C:8](=[O:30])[C:9](=[CH:15][C:16]1[CH:17]=[N:18][C:19]([NH:22][C:23]([O:25][C:26]([CH3:29])([CH3:28])[CH3:27])=[O:24])=[CH:20][CH:21]=1)[C:10]([O:12][CH2:13][CH3:14])=[O:11])[CH3:6].[Cl-].[NH4+]>C(OCC)C.O1CCCC1.N.[Cu](I)I>[CH2:13]([O:12][C:10](=[O:11])[CH:9]([CH:15]([C:16]1[CH:17]=[N:18][C:19]([NH:22][C:23]([O:25][C:26]([CH3:28])([CH3:27])[CH3:29])=[O:24])=[CH:20][CH:21]=1)[CH2:1][CH3:2])[C:8]([O:7][CH2:5][CH3:6])=[O:30])[CH3:14]
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참가 물질

8

반응물 3

HCID 25517Ammonium ChlorideHCID 543379912-(6-Tert-butoxycarbonylaminopyridin-3-ylmethylene)-malonic acid diethyl esterHCID 178418443HCID 178418443, 화합물

생성물 1

HCID 544316442-[1-(6-Tert-butoxycarbonylamino-pyridin-3-yl)-propyl]-malonic acid diethyl ester수율 55%

시약·촉매·용매 4

HCID 83717Copper iodide촉매
HCID 222
Ammonia
용매
HCID 3283Diethyl Ether용매
HCID 8028Tetrahydrofuran용매2회

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온도
-78 °C

실험 절차

To a stirred suspension of copper iodide (5.71 g, 30 mmol) in diethyl ether (120 mL) under argon was added ethylmagnesium bromide (3 M solution in diethyl ether, 20 mL, 20 mmol) within 10 min at 0° C. After 5 min stirring the mixture was cooled to −78° C. and a solution of 2-(6tert-butoxycarbonylamino-pyridin-3-ylmethylene)-malonic acid diethyl ester (5.47 g, 15.0 mmol) in tetrahydrofurane (60 mL) was added dropwise with in 0.5 h. During this period tetrahydrofurane (40 mL) was added. The mixture was allowed to stir at −40° C. for 2.5 h. Then a solution of ammonium chloride (5%) in aqueous ammonia solution (5%) was added with vigorous stirring, allowing access of air, and the mixture was warmed up to room temperature. The mixture was extracted twice with ethyl acetate. The combined organic layers were washed successively with aqueous ammonia solution (5%) and brine, and dried over magnesium sulphate. The solvent was removed under reduced pressure and the residue was recrystallised from a mixture of diisopropyl ether and tetrahydrofurane (5:1, vol./vol.) to give 2-[1-(6-tert-butoxycarbonylamino-pyridin-3-yl)-propyl]-malonic acid diethyl ester (3.23 g, 55%).

후처리

  1. stirringto stir at −40° C. for 2.5 h
  2. temperaturethe mixture was warmed up to room temperature
  3. extractionThe mixture was extracted twice with ethyl acetate
  4. washThe combined organic layers were washed successively with aqueous ammonia solution (5%) and brine
  5. dry with materialdried over magnesium sulphate
  6. customThe solvent was removed under reduced pressure
  7. customthe residue was recrystallised from a mixture of diisopropyl ether and tetrahydrofurane (5:1

출처 및 근거

ORD 기록
ord-2038decc37924e4b995807afaba5bba6
출처 데이터셋
uspto-grants-2006_07
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US07071175B1

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