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Dichloromethane → Benzyl 3-(1-methylcyclohexylcarbonylamino)-4-oxovalerate

HRID 746029
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HRID 746029 반응식
[CH3:1][C:2]1([C:8](Cl)=[O:9])[CH2:7][CH2:6][CH2:5][CH2:4][CH2:3]1.[CH:11]1[CH:16]=[CH:15][C:14]([CH2:17][O:18][C:19]([CH2:21][C@H:22]([NH2:26])[C:23]([OH:25])=O)=[O:20])=[CH:13][CH:12]=1.Cl[CH2:28]Cl>C(N(CC)CC)C>[CH3:1][C:2]1([C:8]([NH:26][CH:22]([C:23](=[O:25])[CH3:28])[CH2:21][C:19]([O:18][CH2:17][C:14]2[CH:13]=[CH:12][CH:11]=[CH:16][CH:15]=2)=[O:20])=[O:9])[CH2:7][CH2:6][CH2:5][CH2:4][CH2:3]1
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참가 물질

5

반응물 3

HCID 6344DichloromethaneHCID 1011864-(Phenylmethyl) hydrogen L-aspartateHCID 41892451-Methylcyclohexanecarbonyl chloride

생성물 1

HCID 23311271Benzyl 3-(1-methylcyclohexylcarbonylamino)-4-oxovalerate

시약·촉매·용매 1

HCID 8471Triethylamine용매

실험 절차

1-Methylcyclohexylcarbonyl chloride (1.6 g) was added dropwise to a mixture of L-aspartic acid β-benzyl ester (2.23 g), dichloromethane (30 ml) and triethylamine (30 ml) with ice-cooling and stirring. The resulting mixture was stirred with ice-cooling for an hour, washed with 1N hydrochloric acid and water and dried over anhydrous magnesium sulfate. The solvent was then distilled off and the oily residue (3.2 g) was dissolved in dimethoxyethane (30 ml). Acetic anhydride (4 ml), pyridine (4.8 ml) and 4-dimethylaminopyridine (0.12 g) were added and the mixture was refluxed for 1.5 hours. Acetic acid (2 ml) was added and the whole mixture was refluxed for 2.5 hours. The solvent was distilled off and water was added. The mixture was extracted with ethyl acetate and the ethyl acetate layer was washed with diluted hydrochloric acid, water, aqueous sodium hydrogen carbonate and water in that order, and dried over anhydrous magnesium sulfate. The residue (2.0 g) was purified by chromatography on silica gel (40 g) [eluent: hexane-acetone (9:1)] to give benzyl 3-(1-methylcyclohexylcarbonylamino)-4-oxovalerate as an oil; yield 1.2 g (34.8%).

후처리

  1. temperaturecooling
  2. stirringThe resulting mixture was stirred with ice-
  3. temperaturecooling for an hour
  4. washwashed with 1N hydrochloric acid and water
  5. dry with materialdried over anhydrous magnesium sulfate
  6. distillationThe solvent was then distilled off
  7. dissolutionthe oily residue (3.2 g) was dissolved in dimethoxyethane (30 ml)
  8. additionAcetic anhydride (4 ml), pyridine (4.8 ml) and 4-dimethylaminopyridine (0.12 g) were added
  9. temperaturethe mixture was refluxed for 1.5 hours
  10. additionAcetic acid (2 ml) was added
  11. temperaturethe whole mixture was refluxed for 2.5 hours
  12. distillationThe solvent was distilled off
  13. additionwater was added
  14. extractionThe mixture was extracted with ethyl acetate
  15. washthe ethyl acetate layer was washed with diluted hydrochloric acid, water, aqueous sodium hydrogen carbonate and water in that order
  16. dry with materialdried over anhydrous magnesium sulfate
  17. customThe residue (2.0 g) was purified by chromatography on silica gel (40 g) [eluent: hexane-acetone (9:1)]

출처 및 근거

ORD 기록
ord-488c54a181064787bca5de4a469968e7
출처 데이터셋
uspto-grants-1986_07
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US04602027

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