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1,1-Dimethylethyl (2S)-2-(3-oxobutyl)-1-pyrrolidinecarboxylate

Base Information Edit
  • Chemical Name:1,1-Dimethylethyl (2S)-2-(3-oxobutyl)-1-pyrrolidinecarboxylate
  • CAS No.:445432-06-4
  • Molecular Formula:C13H23NO3
  • Molecular Weight:241.331
  • Hs Code.:
  • DSSTox Substance ID:DTXSID301176829
  • Nikkaji Number:J1.727.576C
  • Mol file:445432-06-4.mol
1,1-Dimethylethyl (2S)-2-(3-oxobutyl)-1-pyrrolidinecarboxylate

Synonyms:SCHEMBL25969764;DTXSID301176829;445432-06-4;1,1-Dimethylethyl (2S)-2-(3-oxobutyl)-1-pyrrolidinecarboxylate

Suppliers and Price of 1,1-Dimethylethyl (2S)-2-(3-oxobutyl)-1-pyrrolidinecarboxylate
Supply Marketing:Edit
Business phase:
The product has achieved commercial mass production*data from LookChem market partment
Manufacturers and distributors:
  • Manufacture/Brand
  • Chemicals and raw materials
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Total 0 raw suppliers
Chemical Property of 1,1-Dimethylethyl (2S)-2-(3-oxobutyl)-1-pyrrolidinecarboxylate Edit
Chemical Property:
  • XLogP3:1.7
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Rotatable Bond Count:5
  • Exact Mass:241.16779360
  • Heavy Atom Count:17
  • Complexity:294
Purity/Quality:
Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:
Useful:
  • Canonical SMILES:CC(=O)CCC1CCCN1C(=O)OC(C)(C)C
  • Isomeric SMILES:CC(=O)CC[C@@H]1CCCN1C(=O)OC(C)(C)C
Technology Process of 1,1-Dimethylethyl (2S)-2-(3-oxobutyl)-1-pyrrolidinecarboxylate

There total 1 articles about 1,1-Dimethylethyl (2S)-2-(3-oxobutyl)-1-pyrrolidinecarboxylate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:
Guidance literature:
tert-butyl pyrrolidine-1-carboxylate; With sec.-butyllithium; (-)-sparteine; In diethyl ether; at -78 ℃; for 1h;
With lithium chloride; In tetrahydrofuran; diethyl ether; at -78 ℃; for 1h;
methyl vinyl ketone; With chloro-trimethyl-silane; In tetrahydrofuran; diethyl ether; at -78 - 25 ℃; for 42h; Title compound not separated from byproducts;
DOI:10.1021/jo035845i
Guidance literature:
In tetrahydrofuran; at 0 - 20 ℃; for 1h;
Guidance literature:
Multi-step reaction with 5 steps
1: 70 percent / KHMDS / tetrahydrofuran
2: 100 percent / TFA / CH2Cl2 / 20 °C
3: 70 percent / AcOH; NaBH(OAc)3 / tetrahydrofuran
4: 64 percent / KHMDS / diethyl ether / 20 °C
5: 41 percent / cyclic Pd-compound / acetonitrile; dimethylformamide; H2O / 2 h / 120 °C
With potassium hexamethylsilazane; sodium tris(acetoxy)borohydride; acetic acid; trifluoroacetic acid; cyclic Pd-compound; In tetrahydrofuran; diethyl ether; dichloromethane; water; N,N-dimethyl-formamide; acetonitrile;
DOI:10.1016/S0040-4039(02)01219-4
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