Dimethyl piperidine-1,4-dicarboxylate

Base Information

• Chemical Name: Dimethyl piperidine-1,4-dicarboxylate
• CAS No.: 869189-69-5
• Molecular Formula: C9H15NO4
• Molecular Weight: 201.22000
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID00655998
• Wikidata: Q82570430
• Mol file: 869189-69-5.mol

Synonyms:Dimethyl piperidine-1,4-dicarboxylate;869189-69-5;SCHEMBL5271075;DTXSID00655998;1,4-di(methoxycarbonyl)piperidine;Dimethylpiperidine-1,4-dicarboxylate;AKOS009090298

Chemical Property of Dimethyl piperidine-1,4-dicarboxylate

Chemical Property:

• PSA: 55.84000
• LogP: 0.57570
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 201.10010796
• Heavy Atom Count: 14
• Complexity: 221

Purity/Quality:

98% ^*data from raw suppliers

Dimethylpiperidine-1,4-dicarboxylate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC(=O)C1CCN(CC1)C(=O)OC

Technology Process of Dimethyl piperidine-1,4-dicarboxylate

There total 1 articles about Dimethyl piperidine-1,4-dicarboxylate 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:

Reference yield:

isonipecotic acid methyl ester (2971-79-1) + methyl chloroformate (79-22-1) → dimethyl piperidine-1,4-dicarboxylate (869189-69-5)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In dichloromethane; at 0 - 20 ℃;

Reference yield: 100.0%

dimethyl piperidine-1,4-dicarboxylate (869189-69-5) + tert-butyl (R)-(1-(3-(bromomethyl)phenyl)-2-cyanoethyl)carbamate → dimethyl (R)-4-(3-(1-((tert-butoxycarbonyl)amino)-2-cyanoethyl)benzyl)piperidine-1,4-dicarboxylate

Guidance literature:

dimethyl piperidine-1,4-dicarboxylate; With sodium hexamethyldisilazane; In tetrahydrofuran; at -78 - 20 ℃; for 0.5h; Inert atmosphere;

tert-butyl (R)-(1-(3-(bromomethyl)phenyl)-2-cyanoethyl)carbamate; In tetrahydrofuran; at -78 ℃; for 0.25h; Inert atmosphere;

DOI:10.1021/acs.jmedchem.7b01861

upstream raw materials:

isonipecotic acid methyl ester

methyl chloroformate