1-Nonylpiperazine

Base Information

• Chemical Name: 1-Nonylpiperazine
• CAS No.: 82394-25-0
• Molecular Formula: C13H28N2
• Molecular Weight: 212.37
• Hs Code.: 2933599090
• European Community (EC) Number: 671-064-0
• DSSTox Substance ID: DTXSID30371831
• Wikidata: Q82159297
• ChEMBL ID: CHEMBL4103921
• Mol file: 82394-25-0.mol

Synonyms:1-Nonylpiperazine;82394-25-0;1-n-Nonylpiperazine;1-(1-nonyl)-piperazine;1-(n-nonyl)piperazine;Piperazine, 1-nonyl-;MFCD01320897;1-(1-butylpentyl)piperazine;SCHEMBL8723279;CHEMBL4103921;DTXSID30371831;JXSIBFCQEWUEDI-UHFFFAOYSA-N;AKOS009159482;AS-44260;A840321

Chemical Property of 1-Nonylpiperazine

Chemical Property:

• Vapor Pressure: 0.00261mmHg at 25°C
• Refractive Index: 1.456
• Boiling Point: 286.6 °C at 760 mmHg
• Flash Point: 87.6 °C
• PSA: 15.27000
• Density: 0.86 g/cm³
• LogP: 2.90890
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 8
• Exact Mass: 212.225248902
• Heavy Atom Count: 15
• Complexity: 131

Purity/Quality:

98%Min ^*data from raw suppliers

1-nonylpiperazine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCN1CCNCC1

Technology Process of 1-Nonylpiperazine

There total 6 articles about 1-Nonylpiperazine 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: 59.0%

piperazine (110-85-0) + 1-Bromononane (693-58-3) → 1-nonyl piperazine (82394-25-0)

Guidance literature:

In acetonitrile; at 20 ℃; for 12h; Inert atmosphere;

DOI:10.1021/acs.jmedchem.7b01138

Reference yield:

1-nonanoylpiperazine → 1-nonyl piperazine (82394-25-0)

Guidance literature:

In tetrahydrofuran;

Reference yield:

piperazine (110-85-0) + oct-1-ene (111-66-0,25068-25-1) + carbon monoxide (201230-82-2) → 1-nonyl piperazine (82394-25-0) + 1,4-dinonylpiperazine (82394-19-2)

Guidance literature:

With dicarbonylacetylacetonato rhodium (I); hydrogen; 6,6′-[(3,3′-di-tert-butyl-5,5′-dimethoxy-1,1′-biphenyl-2,2′-diyl)bis(oxy)]bis(di-benzo[d,f][1,3,2]dioxaphosphepin); In toluene; at 120 ℃; for 16h; under 15001.5 Torr; Autoclave;

DOI:10.1002/adsc.201500896

upstream raw materials:

piperazine

1-iodononane

1-Bromononane

oct-1-ene

Refernces

• 1、 Seidensticker, Thomas,Vosberg, Jonas M.,Ostrowski, Karoline A.,Vorholt, Andreas J.. "Rhodium-Catalyzed Bis-Hydroaminomethylation of Linear Aliphatic Alkenes with Piperazine". . p. 610 - 621. Retrieved 2016/02/27.
• 2、 -. "ALKYL-SUBSTITUTED COMPOUNDS HAVING DOPAMINE RECEPTOR AFFINITY". . . Retrieved 2008/06/13.