Methyl 2-methylpiperidine-2-carboxylate

Base Information

• Chemical Name: Methyl 2-methylpiperidine-2-carboxylate
• CAS No.: 89115-93-5
• Molecular Formula: C₈H₁₅NO₂
• Molecular Weight: 157.213
• Hs Code.: 2933399990
• DSSTox Substance ID: DTXSID90527630
• Mol file: 89115-93-5.mol

Synonyms:METHYL 2-METHYLPIPERIDINE-2-CARBOXYLATE;89115-93-5;SCHEMBL16068191;DTXSID90527630;MFCD13179033;AKOS015959849;SB41594;AS-36869;CS-0049155;METHYL2-METHYLPIPERIDINE-2-CARBOXYLATE;EN300-374460;2-methyl-piperidine-2-carboxylic acid methyl ester;A915083

Chemical Property of Methyl 2-methylpiperidine-2-carboxylate

Chemical Property:

• PSA: 38.33000
• LogP: 1.02040
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 157.110278721
• Heavy Atom Count: 11
• Complexity: 158

Purity/Quality:

97% ^*data from raw suppliers

Methyl2-methylpiperidine-2-carboxylate 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CCCCN1)C(=O)OC

Technology Process of Methyl 2-methylpiperidine-2-carboxylate

There total 4 articles about Methyl 2-methylpiperidine-2-carboxylate 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:

2-methyl-piperidine-1,2-dicarboxylic acid 1-tert-butyl ester 2-methyl ester (470668-97-4) → 2-methyl-piperidine-2-carboxylic acid methyl ester (89115-93-5)

Guidance literature:

With hydrogenchloride; In dichloromethane; ethyl acetate; for 0.333333h;

Reference yield:

(+/-) methyl N-tert-butyloxycarbonyl 2-piperidinecarboxylate (132910-79-3) → 2-methyl-piperidine-2-carboxylic acid methyl ester (89115-93-5)

Guidance literature:

Multi-step reaction with 2 steps

1: lithium diisopropyl amide / tetrahydrofuran / 3 h / 0 °C

2: hydrogenchloride / dichloromethane; ethyl acetate / 0.33 h

With hydrogenchloride; lithium diisopropyl amide; In tetrahydrofuran; dichloromethane; ethyl acetate;

Reference yield:

6-Chloro-2-methyl-2-{[1-phenyl-meth-(E)-ylidene]-amino}-hexanoic acid methyl ester → 2-methyl-piperidine-2-carboxylic acid methyl ester (89115-93-5)

Guidance literature:

Multistep reaction; 1.) THF, 3-20 h, heating, 2.) H₂O, HCl;

DOI:10.1016/S0040-4039(00)84346-4

upstream raw materials:

(+/-) methyl N-tert-butyloxycarbonyl 2-piperidinecarboxylate

2-methyl-piperidine-1,2-dicarboxylic acid 1-tert-butyl ester 2-methyl ester

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