2,4-Dinitrobenzamide

Base Information

• Chemical Name: 2,4-Dinitrobenzamide
• CAS No.: 13296-87-2
• Molecular Formula: C7H5N3O5
• Molecular Weight: 211.134
• DSSTox Substance ID: DTXSID40395684
• Nikkaji Number: J1.523.852F
• Wikidata: Q82195891
• Mol file: 13296-87-2.mol

Synonyms:2,4-dinitrobenzamide;13296-87-2;Benzamide, 2,4-dinitro-;2,4-Dinitro-benzamide;SCHEMBL3803922;DTXSID40395684;UTESHVANCFLTQV-UHFFFAOYSA-N;BBL002560;STK257644;AKOS003244080;VS-01113;CS-0358979

Chemical Property of 2,4-Dinitrobenzamide

Chemical Property:

• XLogP3: -0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 211.02292027
• Heavy Atom Count: 15
• Complexity: 294

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)N

Technology Process of 2,4-Dinitrobenzamide

There total 9 articles about 2,4-Dinitrobenzamide 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: 89.0%

ammonium hydroxide (1336-21-6) + oxalyl dichloride (79-37-8) + 2,4-dinitrobenzoic acid (610-30-0) → 2,4-dinitrobenzamide (13296-87-2)

Guidance literature:

Reference yield: 87.0%

2,4-dinitro-benzaldehyde-oxime (3236-33-7) → 2,4-dinitrobenzamide (13296-87-2)

Guidance literature:

With C₅₅H₄₅ClN₅P₂Ru⁽¹⁺⁾*Cl^(1-); In water; at 110 ℃; for 12h; Sealed tube;

DOI:10.1039/c6ra07515k

Reference yield: 26.0%

2,4-dinitrobenzaldehyde (528-75-6) → 2,4-dinitrobenzamide (13296-87-2)

Guidance literature:

With ammonium hydroxide; potassium permanganate; at -33 ℃;

DOI:10.1023/B:RUJO.0000044545.10133.96

upstream raw materials:

2,4-dinitrobenzonitrile

2,4-dinitrobenzoic acid

sulfuric acid

2,4-dinitrobenzoyl chloride

Downstream raw materials:

2,4-dinitrobenzoic acid

2-Benzylthio-4-nitrobenzamide

4-nitro-2-octylsulfanyl-benzamide

2-ethylsulfanyl-4-nitro-benzamide

Refernces

• 1、 Szpakiewicz,Grzegozek. "Amination of some 1,3-dinitrobenzenes with liquid ammonia-potassium permanganate". . p. 829 - 833. Retrieved 2007/10/03.
• 2、 Gerasyuto,Zlotin,Semenov. "Synthesis of 2,3-dihydrobenzothiazol-1,1-dioxide and 2,3-dihydro-1,4-benzothiazin-3-one nitroderivatives from 2,4-di- and 2,4,6-trinitrobenzamides". . p. 300 - 304. Retrieved 2007/10/03.