TERT-BUTYL 4-CYANO-4-(PYRIDIN-2-YL)PIPERIDINE-1-CARBOXYLATE

Base Information

• Chemical Name: TERT-BUTYL 4-CYANO-4-(PYRIDIN-2-YL)PIPERIDINE-1-CARBOXYLATE
• CAS No.: 167263-04-9
• Molecular Formula: C16H21N3O2
• Molecular Weight: 287.36
• Hs Code.: 2933990090
• Mol file: 167263-04-9.mol

Synonyms:TERT-BUTYL 4-CYANO-4-(PYRIDIN-2-YL)PIPERIDINE-1-CARBOXYLATE;1-Piperidinecarboxylic acid, 4-cyano-4-(2-pyridinyl)-, 1,1-diMethylethyl ester;1-Boc-4-cyano-4-(2-pyridinyl)-piperidine

Chemical Property of TERT-BUTYL 4-CYANO-4-(PYRIDIN-2-YL)PIPERIDINE-1-CARBOXYLATE

Chemical Property:

• Boiling Point: 444.6±45.0 °C(Predicted)
• PKA: 5.43±0.19(Predicted)
• PSA: 66.22000
• Density: 1.15±0.1 g/cm3(Predicted)
• LogP: 2.81178
• Storage Temp.: 2-8°C

Purity/Quality:

99%min ^*data from raw suppliers

tert-Butyl4-cyano-4-(pyridin-2-yl)piperidine-1-carboxylate >97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of TERT-BUTYL 4-CYANO-4-(PYRIDIN-2-YL)PIPERIDINE-1-CARBOXYLATE

There total 3 articles about TERT-BUTYL 4-CYANO-4-(PYRIDIN-2-YL)PIPERIDINE-1-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: 89.0%

2-fluoropyridine (372-48-5) + 1-tert-butoxycarbonyl-4-cyanopiperidine (91419-52-2) → 1-tert-butoxycarbonyl-4-cyano-4-(pyridin-2-yl)-piperidine (167263-04-9)

Guidance literature:

With lithium hexamethyldisilazane; In tetrahydrofuran; at -78 - 20 ℃; Inert atmosphere;

DOI:10.1016/j.tetlet.2009.08.123

Reference yield: 44.0%

pyridine-2-acetonitrile (2739-97-1) + N-(tert-butyloxycarbonyl)bis(2-chloroethyl)amine (118753-70-1) → 1-tert-butoxycarbonyl-4-cyano-4-(pyridin-2-yl)-piperidine (167263-04-9)

Guidance literature:

With sodium hydride; In DMF (N,N-dimethyl-formamide); oil; at 0 - 60 ℃; for 5.63333h;

Reference yield:

2-fluoropyridine (372-48-5) + 1-(tert-butoxycarbonyl)-4-cyano-2,3,4,5-tetrahydropyridin-1-ium → 1-tert-butoxycarbonyl-4-cyano-4-(pyridin-2-yl)-piperidine (167263-04-9)

Guidance literature:

With lithium hexamethyldisilazane; In tetrahydrofuran; at 18 - 25 ℃; for 1.5h;

upstream raw materials:

pyridine-2-acetonitrile

N-(tert-butyloxycarbonyl)bis(2-chloroethyl)amine

2-fluoropyridine

1-tert-butoxycarbonyl-4-cyanopiperidine

Refernces

• 1、 -. "N-LINKED LACTAM M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS". Page/Page column 41. . Retrieved 2012/12/13.
• 2、 -. "AMINOBENZOQUINAZOLINONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS". Page/Page column 33-34. . Retrieved 2011/08/03.