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N-Allylbenzylamine → 3-(Allyl-benzyl-carbamoyl)-but-3-enoic acid methyl ester

HRID 2240576
Notes
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Reaction equation

HRID 2240576 reaction equation
[CH3:1][O:2][C:3](=[O:10])[CH2:4][C:5](=[CH2:9])[C:6]([O-])=[O:7].C(N=C=N)C.[CH2:16]([NH:19][CH2:20][C:21]1[CH:26]=[CH:25][CH:24]=[CH:23][CH:22]=1)[CH:17]=[CH2:18]>CN(C)C1C=CN=CC=1.C(Cl)Cl>[CH3:1][O:2][C:3](=[O:10])[CH2:4][C:5]([C:6](=[O:7])[N:19]([CH2:16][CH:17]=[CH2:18])[CH2:20][C:21]1[CH:22]=[CH:23][CH:24]=[CH:25][CH:26]=1)=[CH2:9]
ParticipantsProcedureWorkupSources & evidenceReaction notes

Participants

6

Reactant 3

HCID 521150N-AllylbenzylamineHCID 69949442-Methylene-succinate 4-methyl esterHCID 12973440Ethylcarbodiimide

Product 1

HCID 574434143-(Allyl-benzyl-carbamoyl)-but-3-enoic acid methyl esterYield 49%

Reagents, catalysts & solvents 2

HCID 142844-(Dimethylamino)pyridineCatalyst
HCID 6344
Dichloromethane
Solvent

Procedure

587 mg of 2-methylene-succinate 4-methyl ester (4.07 mM), 781 mg of 143-(dimethylamino)propyl]-3-ethylcarbodiimide (4.07 mM) and 75 mg of 4-(dimethylamino)pyridine (0.61 mM) were added to the reaction solution containing 300 mg of allylbenzylamine (2.04 mM) dissolved in methylene chloride solution (0.5M) with stirring for 10 hrs at room temperature. After the resulting mixture was washed with 5% HCl solution (10 ml), the mixture was diluted with ethyl acetate, washed with 10 ml of solution mixture mixed with saturated NaHCO3 solution and saturated NaCl solution to separate into an organic layer and water layer. The organic layer was dried over anhydrous MgSO4, filtered and concentrated in vacuo. The resultant was purified by Silica gel column chromatography with a solvent mixture mixed with EtOAc and hexanes (1:1) as an eluant to give 272 mg of 3-(allyl-benzyl-carbamoyl)-but-3-enoic acid methyl ester (o) (yield: 49%).

Workup

  1. washAfter the resulting mixture was washed with 5% HCl solution (10 ml)
  2. additionthe mixture was diluted with ethyl acetate
  3. washwashed with 10 ml of solution mixture
  4. additionmixed with saturated NaHCO3 solution and saturated NaCl solution
  5. customto separate into an organic layer and water layer
  6. dry with materialThe organic layer was dried over anhydrous MgSO4
  7. filtrationfiltered
  8. concentrationconcentrated in vacuo
  9. customThe resultant was purified by Silica gel column chromatography with a solvent mixture
  10. additionmixed with EtOAc and hexanes (1:1) as an eluant

Sources & evidence

ORD record
ord-3c8b318c324f43ff9c3c7f2f65eb43f6
Source dataset
uspto-grants-2010_05
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US07723376B2

Reaction notes

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On this pageParticipantsProcedureWorkupSources & evidenceReaction notes