Ethyl 1-Boc-piperidine-2-carboxylate

Base Information

• Chemical Name: Ethyl 1-Boc-piperidine-2-carboxylate
• CAS No.: 362703-48-8
• Molecular Formula: C₁₃H₂₃NO₄
• Molecular Weight: 257.33
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID20408125
• Mol file: 362703-48-8.mol

Synonyms:362703-48-8;Ethyl 1-Boc-piperidine-2-carboxylate;1-tert-butyl 2-ethyl piperidine-1,2-dicarboxylate;Ethyl N-Boc-piperidine-2-carboxylate;1,2-Piperidinedicarboxylic acid, 1-(1,1-dimethylethyl) 2-ethyl ester;1-O-tert-butyl 2-O-ethyl piperidine-1,2-dicarboxylate;MFCD03788452;Ethyl N-BOC-pipecolinate;SCHEMBL444202;DTXSID20408125;KBDNAOCLKIBYPH-UHFFFAOYSA-N;Ethyl-N-BOC-piperidine-2-carboxylate;AKOS005259780;AC-22465;DS-11043;SY023684;AM20090576;CS-0008353;FT-0645162;EN300-194062;1-tert-butyl2-ethylpiperidine-1,2-dicarboxylate;J-520529

Chemical Property of Ethyl 1-Boc-piperidine-2-carboxylate

Chemical Property:

• Vapor Pressure: 0.000254mmHg at 25°C
• Refractive Index: 1.473
• Boiling Point: 323.9 °C at 760 mmHg
• PKA: -3.16±0.40(Predicted)
• Flash Point: 149.7 °C
• PSA: 55.84000
• Density: 1.077 g/cm³
• LogP: 2.27700
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 257.16270821
• Heavy Atom Count: 18
• Complexity: 309

Purity/Quality:

98% ^*data from raw suppliers

Ethyl 1-boc-piperidine-2-carboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1CCCCN1C(=O)OC(C)(C)C

Technology Process of Ethyl 1-Boc-piperidine-2-carboxylate

There total 4 articles about Ethyl 1-Boc-piperidine-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: 82.0%

ethanol (64-17-5) + (S)-(-)-1-(tert-butoxycarbonyl)-2-piperidinecarboxylic acid (26250-84-0) → N-Boc-L-pipecolic acid ethyl ester (502633-94-5,362703-48-8)

Guidance literature:

DOI:10.1016/j.nimb.2005.11.149

Reference yield: 64.0%

di-tert-butyl dicarbonate (24424-99-5) + ethyl pipecolate (15862-72-3) → ethyl N-Boc-pipecolinate (362703-48-8)

Guidance literature:

di-tert-butyl dicarbonate; ethyl pipecolate; dmap; In dichloromethane; for 1h;

In dichloromethane;

Reference yield:

di-tert-butyl dicarbonate (24424-99-5) → N-Boc-L-pipecolic acid ethyl ester (502633-94-5,362703-48-8)

Guidance literature:

Multi-step reaction with 2 steps

1: NaHCO₃ / methanol

With sodium hydrogencarbonate; In methanol;

DOI:10.1016/j.nimb.2005.11.149

upstream raw materials:

di-tert-butyl dicarbonate

ethyl pipecolate

ethanol

(S)-(-)-1-(tert-butoxycarbonyl)-2-piperidinecarboxylic acid