N-(4-cyanophenyl)-2-nitrobenzamide

Base Information

Chemical Name:N-(4-cyanophenyl)-2-nitrobenzamide
CAS No.:95202-37-2
Molecular Formula:C14H9N3O3
Molecular Weight:267.24000
Hs Code.:
DSSTox Substance ID:DTXSID00350234
Wikidata:Q82126070
Mol file:95202-37-2.mol

Synonyms:N-(4-cyanophenyl)-2-nitrobenzamide;95202-37-2;Oprea1_753172;Oprea1_869130;DTXSID00350234;STK003623;AKOS000192428;AN-329/12072560

Suppliers and Price of N-(4-cyanophenyl)-2-nitrobenzamide

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

Aronis compounds
N-(4-cyanophenyl)-2-nitrobenzamide
20mg
$ 30.00

Total 0 raw suppliers

Chemical Property of N-(4-cyanophenyl)-2-nitrobenzamide

Chemical Property:

PSA：98.71000
LogP:3.31498
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:267.06439116
Heavy Atom Count:20
Complexity:415

Purity/Quality:: N-(4-cyanophenyl)-2-nitrobenzamide ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)C#N)[N+](=O)[O-]

Technology Process of N-(4-cyanophenyl)-2-nitrobenzamide

There total 3 articles about N-(4-cyanophenyl)-2-nitrobenzamide 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: 84.0%

: 873-74-5
4-Aminobenzonitrile

: 610-14-0
2-nitrobenzyl chloride

: 95202-37-2
N-(4-cyanophenyl)-2-nitrobenzamide

Guidance literature:: With triethylamine; In dichloromethane; at 20 ℃; for 3h; Inert atmosphere;
DOI:10.3390/ijms18061144

Reference yield:

: 552-16-9,104810-18-6
ortho-nitrobenzoic acid

: 95202-37-2
N-(4-cyanophenyl)-2-nitrobenzamide

Guidance literature:: Multi-step reaction with 2 steps

1: oxalyl dichloride; triethylamine / dichloromethane / 1 h / 20 °C / Inert atmosphere; Reflux

2: triethylamine / dichloromethane / 3 h / 20 °C / Inert atmosphere

With oxalyl dichloride; triethylamine; In dichloromethane;
DOI:10.3390/ijms18061144