1,4-Dinicotinoylpiperazine

Base Information

• Chemical Name: 1,4-Dinicotinoylpiperazine
• CAS No.: 17433-19-1
• Molecular Formula: C16H16N4O2
• Molecular Weight: 296.329
• Hs Code.: 2933990090
• European Community (EC) Number: 241-457-8
• DSSTox Substance ID: DTXSID90169817
• Nikkaji Number: J287.051G
• Wikidata: Q83039591
• Mol file: 17433-19-1.mol

Synonyms:1,4-Dinicotinoylpiperazine;17433-19-1;EINECS 241-457-8;[4-(pyridine-3-carbonyl)piperazin-1-yl]-pyridin-3-ylmethanone;Piperazine, 1,4-bis(3-pyridinylcarbonyl)-;N,N'-Bis(nicotinoyl)piperazine;SCHEMBL9763711;N,N'-Bis(nicotinoyl)-piperazine;DTXSID90169817;STK467491;AKOS003289287;piperazine-1,4-diylbis(pyridin-3-ylmethanone)

Chemical Property of 1,4-Dinicotinoylpiperazine

Chemical Property:

• Vapor Pressure: 1.07E-11mmHg at 25°C
• Boiling Point: 539.2°Cat760mmHg
• Flash Point: 279.9°C
• PSA: 66.40000
• Density: 1.293g/cm³
• LogP: 0.95060
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 296.12732577
• Heavy Atom Count: 22
• Complexity: 369

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCN1C(=O)C2=CN=CC=C2)C(=O)C3=CN=CC=C3

Technology Process of 1,4-Dinicotinoylpiperazine

There total 6 articles about 1,4-Dinicotinoylpiperazine 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: 70.0%

piperazine (110-85-0) + pyridine-3-carbonyl chloride hydrochloride (20260-53-1) → N,N′-bis(3-pyridinecarboxamide)piperazine (17433-19-1)

Guidance literature:

piperazine; pyridine-3-carbonyl chloride hydrochloride; With triethylamine; In dichloromethane; at 0 - 20 ℃; for 24.5h; Inert atmosphere;

With sodium hydrogencarbonate; In dichloromethane; water; Inert atmosphere;

DOI:10.1039/c0dt00337a

Reference yield: 40.0%

piperazine (110-85-0) + nicotinic acid (59-67-6) → N,N′-bis(3-pyridinecarboxamide)piperazine (17433-19-1)

Guidance literature:

With pyridine; thionyl chloride; sodium sulfate; at 60 - 110 ℃; for 12h;

Reference yield: 38.0%

piperazine (110-85-0) + 3-pyridinecarbonyl chloride (10400-19-8) → N,N′-bis(3-pyridinecarboxamide)piperazine (17433-19-1)

Guidance literature:

With triethylamine; In chloroform; for 5h; Heating;

DOI:10.1002/ardp.200500220

upstream raw materials:

piperazine

3-pyridinecarbonyl chloride

nicotinic acid

pyridine-3-carbonyl chloride hydrochloride

Refernces

• 1、 -. "Metal-organic complex based on Evans-Showell type polyacid and preparing method and application of complex". Paragraph 0055-0058. . Retrieved 2019/06/30.
• 2、 Hou, Hongwei,Song, Yinglin,Xu, Hong,Wei, Yongli,Fan, Yaoting,Zhu, Yu,Li, Linke,Du, Chenxia. "Polymeric complexes with "piperazine-pyridine" building blocks: Synthesis, network structures, and third-order nonlinear optical properties". . p. 999 - 1008. Retrieved 2007/10/03.