3-(3-nitrophenyl)-1H-1,2,4-triazole

Base Information

Chemical Name:3-(3-nitrophenyl)-1H-1,2,4-triazole
CAS No.:6219-53-0
Molecular Formula:C₈H₆N₄O₂
Molecular Weight:190.161
Hs Code.:
DSSTox Substance ID:DTXSID401295187
Nikkaji Number:J3.621.399J

Synonyms:3-(3-nitrophenyl)-1H-1,2,4-triazole;6219-53-0;5-(3-Nitrophenyl)-1H-1,2,4-triazole;SCHEMBL4331798;SCHEMBL20242176;STXJRVLVLGGYPJ-UHFFFAOYSA-N;DTXSID401295187;5-(m-nitrophenyl)-1,2,4-triazole;MFCD23703657;3-(3-nitrophenyl)-1,2,4-triazole;AKOS005188427;AKOS016347627;3-(3-nitrophenyl)-4h-1,2,4-triazole;SY172952;EN300-35600;Z359387362

Suppliers and Price of 3-(3-nitrophenyl)-1H-1,2,4-triazole

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 3 raw suppliers

Chemical Property of 3-(3-nitrophenyl)-1H-1,2,4-triazole

Chemical Property:

XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:190.04907545
Heavy Atom Count:14
Complexity:218

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=CC(=C1)[N+](=O)[O-])C2=NC=NN2

Technology Process of 3-(3-nitrophenyl)-1H-1,2,4-triazole

There total 3 articles about 3-(3-nitrophenyl)-1H-1,2,4-triazole 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: 95.0%

: N-(1,2,2,2-tetrachloroethyl)-3-nitrobenzimidoyl chloride

: 6219-53-0
3-(3-nitrophenyl)-1,2,4-triazole

Guidance literature:: With hydrazine hydrate; In chloroform; at 20 ℃; for 24h;
DOI:10.1016/j.tet.2016.10.045

Reference yield: 48.0%

: 64781-78-8
3-diazo-3H-[1,2,4]triazole

: 98-95-3,26969-40-4
nitrobenzene

: 74-90-8
hydrogen cyanide

: 201230-82-2
carbon monoxide

: 6219-53-0
5-(m-nitrophenyl)-1H-1,2,4-triazole

: 586-96-9
Nitrosobenzene

Guidance literature:: at 185 ℃;
DOI:10.1016/S0040-4039(00)95476-5

Reference yield:

: 357639-01-1
N-(2,2,2-trichloro-1-hydroxyethyl)-3-nitrobenzamide

: 6219-53-0
3-(3-nitrophenyl)-1,2,4-triazole

Guidance literature:: Multi-step reaction with 2 steps

1: trichlorophosphate; phosphorus pentachloride / 2 h / Reflux

2: hydrazine hydrate / chloroform / 24 h / 20 °C

With phosphorus pentachloride; hydrazine hydrate; trichlorophosphate; In chloroform;
DOI:10.1016/j.tet.2016.10.045