Agn-PC-0N6ayq

Base Information

• Chemical Name: Agn-PC-0N6ayq
• CAS No.: 55833-06-2
• Molecular Formula: C17H17N2+
• Molecular Weight: 249.3297
• NSC Number: 80270
• DSSTox Substance ID: DTXSID90441584
• Mol file: 55833-06-2.mol

Synonyms:55833-06-2;AGN-PC-0N6AYQ;DTXSID90441584;NSC80270;NSC-80270

Chemical Property of Agn-PC-0N6ayq

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 328.05751
• Heavy Atom Count: 20
• Complexity: 228

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CN2C=CC=[N+]2CC3=CC=CC=C3.[Br-]

Technology Process of Agn-PC-0N6ayq

There total 2 articles about Agn-PC-0N6ayq 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:

1-benzylpyrazole (10199-67-4) + 1-iodo-butane (542-69-8) → 1-n-butylpyrazole (52096-24-9) + 1,2-dibenzylpyrazolium bromide (55833-06-2) + 1,2-dibutylpyrazolium iodide + 2-benzyl-1-butyl-2H-pyrazol-1-ium; iodide

Guidance literature:

for 0.166667h; Further Variations:; Temperatures; var. power irradiation; var. time; Product distribution; Irradiation;

DOI:10.1002/jhet.5570360410

Reference yield:

NH-pyrazole (288-13-1) + benzyl bromide (100-39-0) → 1-benzylpyrazole (10199-67-4) + 1,2-dibenzylpyrazolium bromide (55833-06-2)

Guidance literature:

With potassium carbonate; at 150 ℃; for 0.0333333h; Irradiation;

DOI:10.1002/jhet.5570360410

upstream raw materials:

NH-pyrazole

benzyl bromide

1-benzylpyrazole

1-iodo-butane