4-(Piperidin-4-yl)pyrimidine

Base Information

• Chemical Name: 4-(Piperidin-4-yl)pyrimidine
• CAS No.: 954220-47-4
• Molecular Formula: C₉H₁₃N₃
• Molecular Weight: 163.222
• Hs Code.: 2933990090
• European Community (EC) Number: 824-869-8
• DSSTox Substance ID: DTXSID20591506
• Wikidata: Q72500976
• Mol file: 954220-47-4.mol

Synonyms:4-(piperidin-4-yl)pyrimidine;954220-47-4;4-piperidin-4-ylpyrimidine;4-(4-piperidinyl)pyrimidine;PYRIMIDINE, 4-(4-PIPERIDINYL)-;SCHEMBL9557367;DTXSID20591506;MFCD09756530;AKOS010997548;AB51552;CCG-210044;PS-0329;AC-27276;DB-031987;CS-0186896;EN300-59370;F15209;Z854065836

Chemical Property of 4-(Piperidin-4-yl)pyrimidine

Chemical Property:

• Vapor Pressure: 0.00164mmHg at 25°C
• Refractive Index: 1.526
• Boiling Point: 294.3 °C at 760 mmHg
• PKA: 9.91±0.10(Predicted)
• Flash Point: 131.8 °C
• PSA: 37.81000
• Density: 1.065 g/cm³
• LogP: 1.27240
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 163.110947427
• Heavy Atom Count: 12
• Complexity: 132

Purity/Quality:

97% ^*data from raw suppliers

4-(piperidin-4-yl)pyrimidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CNCCC1C2=NC=NC=C2

Technology Process of 4-(Piperidin-4-yl)pyrimidine

There total 1 articles about 4-(Piperidin-4-yl)pyrimidine 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:

C14H21N3O2 (1266114-58-2) → 4-(piperidin-4-yl)pyrimidine (954220-47-4)

Guidance literature:

DOI:10.1016/j.bmcl.2007.12.029

Reference yield:

3,5-bis(trifluoromethyl)benzyl 3-oxo-1-isopropylcyclopentane-carboxamide (400770-73-2) + 4-(piperidin-4-yl)pyrimidine (954220-47-4) → C27H32F6N4O + C27H32F6N4O

Guidance literature:

With 4 A molecular sieve; sodium tris(acetoxy)borohydride; triethylamine; In dichloromethane;

DOI:10.1016/j.bmcl.2007.12.029

upstream raw materials:

C₁₄H₂₁N₃O₂

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