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Bromoacetic Acid → 2-(((Tert-butoxy)carbonyl)(propyl)amino)acetic acid

HRID 18384
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HRID 18384 반응식
Br[CH2:2][C:3]([OH:5])=[O:4].[CH2:6]([NH2:9])[CH2:7][CH3:8].[OH-].[Na+].[C:12](=O)([O:18]C(C)(C)C)[O:13][C:14]([CH3:17])([CH3:16])[CH3:15].O.C(O)(=O)CC(CC(O)=O)(C(O)=O)O>O1CCCC1.C(O)C>[C:14]([O:13][C:12]([N:9]([CH2:2][C:3]([OH:5])=[O:4])[CH2:6][CH2:7][CH3:8])=[O:18])([CH3:17])([CH3:16])[CH3:15]
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참가 물질

8

반응물 5

HCID 6227Bromoacetic AcidHCID 7852PropylamineHCID 14798Sodium HydroxideHCID 222302-Hydroxy-1,2,3-propanetricarboxylic acid hydrate (1:1)HCID 10219638Carbonic acid, bis(1,1-dimethylethyl) ester

생성물 1

HCID 121366292-(((Tert-butoxy)carbonyl)(propyl)amino)acetic acid수율 65%

시약·촉매·용매 2

HCID 702Ethanol용매HCID 8028Tetrahydrofuran용매

실험 절차

Ethanol (36 ml) was added to bromoacetic acid (5.00 g, 36.0 mmol), and the mixture was stirred under ice-cold water-cooling. Propylamine (14.8 ml, 180 mmol) was added to the mixture over one minute, and then the whole was stirred at an external temperature of 80° C. for 2.5 hours. A 4 N aqueous sodium hydroxide solution (27 ml) was added to the reaction mixture, the whole was concentrated under reduced pressure, then water (27 ml) and tetrahydrofuran (30 ml) were added to the concentrate, and the whole was stirred at room temperature. A solution of di-t-butyl carbonate (9.43 g, 43.2 mmol) in tetrahydrofuran (6 ml) was added thereto, and after 15 minutes, citric acid monohydrate was added thereto to weakly acidify the whole. The whole was extracted with ethyl acetate (150 ml). The organic layer was washed with water (100 ml) and saturated brine (50 ml) successively, dried over sodium sulfate and concentrated under reduced pressure. The resulting residue was separated by silica gel column chromatography to give 2-[N-(t-butoxycarbonyl)-N-propylamino]acetic acid (5.06 g, 65%) as a colorless solid.

후처리

  1. temperaturecooling
  2. stirringthe whole was stirred at an external temperature of 80° C. for 2.5 hours
  3. concentrationthe whole was concentrated under reduced pressure
  4. additionwater (27 ml) and tetrahydrofuran (30 ml) were added to the concentrate
  5. stirringthe whole was stirred at room temperature
  6. extractionThe whole was extracted with ethyl acetate (150 ml)
  7. washThe organic layer was washed with water (100 ml) and saturated brine (50 ml) successively
  8. dry with materialdried over sodium sulfate
  9. concentrationconcentrated under reduced pressure
  10. customThe resulting residue was separated by silica gel column chromatography

출처 및 근거

ORD 기록
ord-0e90028571b14ce3ad1b49b7064d3258
출처 데이터셋
uspto-grants-2010_06
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US07741346B2

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