N-(2-Nitrophenyl)-N-phenylnitrous amide

Base Information

• Chemical Name: N-(2-Nitrophenyl)-N-phenylnitrous amide
• CAS No.: 21565-15-1
• Molecular Formula: C12H9N3O3
• Molecular Weight: 243.222
• Hs Code.: 2928000090
• DSSTox Substance ID: DTXSID50511070
• Nikkaji Number: J140.990E
• Wikidata: Q82369678
• Mol file: 21565-15-1.mol

Synonyms:21565-15-1;N-(2-Nitrophenyl)-N-phenylnitrous amide;DTXSID50511070

Chemical Property of N-(2-Nitrophenyl)-N-phenylnitrous amide

Chemical Property:

• Melting Point: 99-100 °C
• Boiling Point: 425.2±37.0 °C(Predicted)
• PKA: -8.27±0.50(Predicted)
• PSA: 78.49000
• Density: 1.30±0.1 g/cm3(Predicted)
• LogP: 3.93750
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 243.06439116
• Heavy Atom Count: 18
• Complexity: 299

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of N-(2-Nitrophenyl)-N-phenylnitrous amide

There total 5 articles about N-(2-Nitrophenyl)-N-phenylnitrous amide 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:

2-nitro-N-phenylaniline (119-75-5) → N-nitroso(2-nitrophenyl)phenylamine (21565-15-1)

Guidance literature:

With potassium nitrite; acetic acid;

Reference yield:

N-nitrosodiphenylamine (382165-80-2,86-30-6) → p-nitrodiphenylnitrosamine (3665-70-1) + N-nitroso(2-nitrophenyl)phenylamine (21565-15-1)

Guidance literature:

With acetic acid; Nitrieren;

Reference yield:

nitric acid (7697-37-2,78989-43-2) + N-nitrosodiphenylamine (382165-80-2,86-30-6) → p-nitrodiphenylnitrosamine (3665-70-1) + N-nitroso(2-nitrophenyl)phenylamine (21565-15-1)

Guidance literature:

upstream raw materials:

2-nitro-N-phenylaniline

N-nitrosodiphenylamine

nitric acid

acetic acid

Downstream raw materials:

2-nitro-N-(4-nitrophenyl)benzenamine

bis(2,4-dinitrophenyl)amine

(2,4-dinitro-phenyl)-(2-nitro-phenyl)-amine

bis(2-nitrophenyl)amine

Refernces