Benzenamine, 2,6-diethynyl-4-nitro-

Base Information

Chemical Name:Benzenamine, 2,6-diethynyl-4-nitro-
CAS No.:716380-66-4
Molecular Formula:C10H6N2O2
Molecular Weight:186.17
Hs Code.:
DSSTox Substance ID:DTXSID00465392
Nikkaji Number:J2.057.009A
Wikidata:Q82291278

Synonyms:Benzenamine, 2,6-diethynyl-4-nitro-;716380-66-4;SCHEMBL21121958;DTXSID00465392

Suppliers and Price of Benzenamine, 2,6-diethynyl-4-nitro-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 1 raw suppliers

Chemical Property of Benzenamine, 2,6-diethynyl-4-nitro-

Chemical Property:

XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:186.042927438
Heavy Atom Count:14
Complexity:301

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C#CC1=CC(=CC(=C1N)C#C)[N+](=O)[O-]

Technology Process of Benzenamine, 2,6-diethynyl-4-nitro-

There total 2 articles about Benzenamine, 2,6-diethynyl-4-nitro- 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: 78.0%

: 4-nitro-2,6-bis-trimethylsilanylethynyl-phenylamine

: 716380-66-4
2,6-diethynyl-4-nitroaniline

Guidance literature:: With potassium hydroxide; In methanol; for 0.333333h;
DOI:10.1081/SCC-200025604

Reference yield:

: 5398-27-6
2,6-diiodo-4-nitroaniline

: 716380-66-4
2,6-diethynyl-4-nitroaniline

Guidance literature:: Multi-step reaction with 2 steps

1: 45 percent / bis(triphenylphosphine)palladium(II)dichloride; copper(II) acetate; diisopropylamine / 1 h / 20 °C

2: 78 percent / aq. KOH / methanol / 0.33 h

With bis-triphenylphosphine-palladium(II) chloride; potassium hydroxide; copper diacetate; diisopropylamine; In methanol;
DOI:10.1081/SCC-200025604

Reference yield: 91.0%

: 622-37-7
Phenyl azide

: 716380-66-4
2,6-diethynyl-4-nitroaniline

: 2,6-bis(1-phenyl-1,2,3-triazol-4-yl)-4-nitroaniline

Guidance literature:: With copper(II) sulfate; sodium L-ascorbate; In tetrahydrofuran; water; at 20 ℃; for 12h; Inert atmosphere;
DOI:10.1016/j.cplett.2018.07.042