4,6-Dinitro-2-phenyl-2h-benzotriazole 1-oxide

Base Information

Chemical Name:4,6-Dinitro-2-phenyl-2h-benzotriazole 1-oxide
CAS No.:6631-41-0
Molecular Formula:C₁₂H₇N₅O₅
Molecular Weight:301.218
Hs Code.:
NSC Number:53094
DSSTox Substance ID:DTXSID20287876
Wikidata:Q82024062

Synonyms:6631-41-0;4,6-dinitro-2-phenyl-2h-benzotriazole 1-oxide;NSC53094;SCHEMBL3283459;DTXSID20287876;NSC-53094

Suppliers and Price of 4,6-Dinitro-2-phenyl-2h-benzotriazole 1-oxide

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
Packaging
price

Total 2 raw suppliers

Chemical Property of 4,6-Dinitro-2-phenyl-2h-benzotriazole 1-oxide

Chemical Property:

Vapor Pressure:3.72E-12mmHg at 25°C
Boiling Point:550.2°C at 760 mmHg
Flash Point:286.6°C
Density:1.72g/cm³
XLogP3:3.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:301.04471834
Heavy Atom Count:22
Complexity:446

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)N2N=C3C(=CC(=CC3=[N+]2[O-])[N+](=O)[O-])[N+](=O)[O-]

Technology Process of 4,6-Dinitro-2-phenyl-2h-benzotriazole 1-oxide

There total 3 articles about 4,6-Dinitro-2-phenyl-2h-benzotriazole 1-oxide 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: 51.0%

: 6295-89-2
N-phenyl-N'-picryl-hydrazine

: 6631-41-0
2-phenyl-4,5-dinitrobenzotriazole 1-oxide

Guidance literature:: In acetic acid;
DOI:10.1139/v01-020

Reference yield:

: 88-88-0
2,4,6-trinitrochlorobenzene

: 6631-41-0
2-phenyl-4,5-dinitrobenzotriazole 1-oxide

Guidance literature:: Multi-step reaction with 2 steps

1: 69 percent / aq. ethanol / 3 h / Heating

2: 51 percent / acetic acid

In ethanol; acetic acid;
DOI:10.1139/v01-020

Reference yield:

: 100-63-0
phenylhydrazine

: 6631-41-0
2-phenyl-4,5-dinitrobenzotriazole 1-oxide

Guidance literature:: Multi-step reaction with 2 steps

1: 69 percent / aq. ethanol / 3 h / Heating

2: 51 percent / acetic acid

In ethanol; acetic acid;
DOI:10.1139/v01-020