1-(Cyclobutylcarbonyl)-3-piperidinecarboxylic acid

Base Information

• Chemical Name: 1-(Cyclobutylcarbonyl)-3-piperidinecarboxylic acid
• CAS No.: 926214-73-5
• Molecular Formula: C₁₁H₁₇NO₃
• Molecular Weight: 211.261
• DSSTox Substance ID: DTXSID00588171
• Mol file: 926214-73-5.mol

Synonyms:926214-73-5;1-(CYCLOBUTYLCARBONYL)-3-PIPERIDINECARBOXYLIC ACID;1-(cyclobutanecarbonyl)piperidine-3-carboxylic acid;1-cyclobutanecarbonylpiperidine-3-carboxylic acid;1-(cyclobutylcarbonyl)piperidine-3-carboxylic acid;DTXSID00588171;MFCD09043166;AKOS000127020;AKOS017272218;MCULE-9108457994;LS-10611;CS-0271258;1-(Cyclobutylcarbonyl)-3-piperidinecarboxylicacid;1-(cyclobutanecarbonyl)piperidine-3-carboxylicacid;Z85893877

Chemical Property of 1-(Cyclobutylcarbonyl)-3-piperidinecarboxylic acid

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 422.85°C at 760 mmHg
• Flash Point: 209.533°C
• PSA: 57.61000
• Density: 1.257g/cm³
• LogP: 1.04760
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 211.12084340
• Heavy Atom Count: 15
• Complexity: 273

Purity/Quality:

98%min ^*data from raw suppliers

1-(cyclobutylcarbonyl)piperidine-3-carboxylicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(C1)C(=O)N2CCCC(C2)C(=O)O

Technology Process of 1-(Cyclobutylcarbonyl)-3-piperidinecarboxylic acid

There total 6 articles about 1-(Cyclobutylcarbonyl)-3-piperidinecarboxylic acid 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: 95.0%

C12H19NO3 (1310485-99-4) → C11H17NO3 (1310486-00-0,926214-73-5)

Guidance literature:

With water; lithium hydroxide; In tetrahydrofuran;

DOI:10.1016/j.bmcl.2010.11.119

Reference yield:

(R)-nipecotic acid (498-95-3,25137-00-2,59045-82-8,60252-41-7,262853-93-0) → C11H17NO3 (926214-73-5)

Guidance literature:

Multi-step reaction with 3 steps

1: thionyl chloride

2: N-ethyl-N,N-diisopropylamine / dichloromethane

3: water; lithium hydroxide / tetrahydrofuran

With thionyl chloride; water; N-ethyl-N,N-diisopropylamine; lithium hydroxide; In tetrahydrofuran; dichloromethane;

DOI:10.1016/j.bmcl.2010.11.119

Reference yield:

(S)-nipecotic acid (498-95-3,25137-00-2,59045-82-8,60252-41-7,262853-93-0) → C11H17NO3 (1310486-00-0,926214-73-5)

Guidance literature:

Multi-step reaction with 3 steps

1: thionyl chloride

2: N-ethyl-N,N-diisopropylamine / dichloromethane

3: water; lithium hydroxide / tetrahydrofuran

With thionyl chloride; water; N-ethyl-N,N-diisopropylamine; lithium hydroxide; In tetrahydrofuran; dichloromethane;

DOI:10.1016/j.bmcl.2010.11.119

upstream raw materials:

C₁₂H₁₉NO₃

(S)-piperidine-3-carboxylic acid methyl ester hydrochloride

(S)-nipecotic acid

(R)-piperidine-3-carboxylic acid methyl ester hydrochloride

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