N-(3-Nitrophenyl)benzenecarboximidoyl chloride

Base Information

• Chemical Name: N-(3-Nitrophenyl)benzenecarboximidoyl chloride
• CAS No.: 52807-30-4
• Molecular Formula: C₁₃H₉ClN₂O₂
• Molecular Weight: 260.68
• DSSTox Substance ID: DTXSID501246276
• Mol file: 52807-30-4.mol

Synonyms:N-(3-Nitrophenyl)benzenecarboximidoyl chloride;DTXSID501246276;52807-30-4

Chemical Property of N-(3-Nitrophenyl)benzenecarboximidoyl chloride

Chemical Property:

• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 260.0352552
• Heavy Atom Count: 18
• Complexity: 321

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

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

Technology Process of N-(3-Nitrophenyl)benzenecarboximidoyl chloride

There total 2 articles about N-(3-Nitrophenyl)benzenecarboximidoyl chloride 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:

N-(3-nitrophenyl)benzamide (4771-08-8) → N-(3-nitro-phenyl)-benzimidoyl chloride (52807-30-4)

Guidance literature:

With phosphorus pentachloride;

Reference yield:

→ N-(3-nitro-phenyl)-benzimidoyl chloride (52807-30-4)

Guidance literature:

entspr. Benzanilid, PCl5;

Reference yield:

N-(3-nitro-phenyl)-benzimidoyl chloride (52807-30-4) → 1-(3-nitro-phenyl)-5-phenyl-1H-tetrazole (65697-44-1)

Guidance literature:

With sodium azide; tetrabutylammomium bromide; In dichloromethane; water; at 20 - 25 ℃; for 1h; Yield given;

DOI:10.1055/s-1996-4418

upstream raw materials:

N-(3-nitrophenyl)benzamide

Downstream raw materials:

5,6-dimethyl-3-(3-nitro-phenyl)-2-phenyl-3H-pyrimidin-4-one

5-ethyl-6-methyl-3-(3-nitro-phenyl)-2-phenyl-3H-pyrimidin-4-one

N,N-dimethyl-N'-(3-nitro-phenyl)-benzamidine

N-(3-nitro-phenyl)-N'-phenyl-benzamidine

Refernces

• 1、 Zielinski, Wojciech,Kudelko, Agnieszka. "Synthesis and basicity of 4-amino-2-phenylquinazolines". . p. 895 - 899. Retrieved 2007/10/03.