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Diethyl Ether → [2-(5,5-Dimethyl-2-oxo-imidazolidin-1-yl)-ethyl]-carbamic acid tert-butyl ester

HRID 2267283
Notes
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Reaction equation

HRID 2267283 reaction equation
[C:1]([O:5][C:6](=[O:16])[NH:7][CH2:8][CH2:9][NH:10][C:11]([C:14]#[N:15])([CH3:13])[CH3:12])([CH3:4])([CH3:3])[CH3:2].[H-].[H-].[H-].[H-].[Li+].[Al+3].C[CH2:24][O:25]CC.CCN(C(C)C)C(C)C.ClC(OC1C=CC([N+]([O-])=O)=CC=1)=O>C1COCC1>[C:1]([O:5][C:6](=[O:16])[NH:7][CH2:8][CH2:9][N:10]1[C:11]([CH3:13])([CH3:12])[CH2:14][NH:15][C:24]1=[O:25])([CH3:4])([CH3:2])[CH3:3]
ParticipantsProcedureWorkupSources & evidenceReaction notes

Participants

7

Reactant 5

HCID 3283Diethyl EtherHCID 81531DiisopropylethylamineHCID 821294-Nitrophenyl chloroformateHCID 21226445Aluminium lithium hydrideHCID 57428805{2-[(Cyano-dimethyl-methyl)-amino]-ethyl}-carbamic acid tert-butyl ester

Product 1

HCID 57428814
[2-(5,5-Dimethyl-2-oxo-imidazolidin-1-yl)-ethyl]-carbamic acid tert-butyl ester
Yield 54%

Reagents, catalysts & solvents 1

HCID 8028TetrahydrofuranSolvent3×

Procedure

{2-[(Cyano-dimethyl-methyl)-amino]-ethyl}-carbamic acid tert-butyl ester (0.74 g., 3.3 mmol) was dissolved in THF (2 mL), cooled in an ice bath, and a 1.0 M solution of LiAlH4 in Et2O (6.5 mL, 6.5 mmol) was added dropwise. The resulting suspension was stirred in the ice bath for 3 h and then quenched (i. 0.17 mL of water; ii. 0.17 mL of 4 M aqueous NaOH; iii. 0.84 mL of water). The resulting mixture was diluted with THF (50 mL) and stirred for 15 min. The mixture was filtered and the filtrate concentrated to give an oil. The oil was dissolved in THF (10 mL), DIPEA (1.4 mL) was added, and the mixture was stirred in an ice bath. A solution of p-nitrophenyl chloroformate (800 mg, 4.0 mmol) in THF (8 mL) was added dropwise and the resulting yellow solution was stirred for 16 h. The mixture was concentrated, dissolved in DCM (50 mL) and washed with 0.5 M HCl (50 mL) followed by saturated aqueous NaHCO3 solution (50 mL). The organic layer was dried (Na2SO4), concentrated and purified by flash chromatography (EtOAc) to give the product as a pale yellow gum (450 mg, 54%).

Workup

  1. temperaturecooled in an ice bath
  2. customquenched (i. 0.17 mL of water; ii. 0.17 mL of 4 M aqueous NaOH; iii. 0.84 mL of water)
  3. additionThe resulting mixture was diluted with THF (50 mL)
  4. filtrationThe mixture was filtered
  5. concentrationthe filtrate concentrated
  6. customto give an oil
  7. stirringthe mixture was stirred in an ice bath
  8. stirringthe resulting yellow solution was stirred for 16 h
  9. concentrationThe mixture was concentrated
  10. dissolutiondissolved in DCM (50 mL)
  11. washwashed with 0.5 M HCl (50 mL)
  12. dry with materialThe organic layer was dried (Na2SO4)
  13. concentrationconcentrated
  14. custompurified by flash chromatography (EtOAc)

Sources & evidence

ORD record
ord-ac0af608a75c421496204be8dd0aea43
Source dataset
uspto-grants-2010_12
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US07858785B2

Reaction notes

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On this pageParticipantsProcedureWorkupSources & evidenceReaction notes