2-[(4-Nitrophenyl)carbamoyl]benzoic acid

Base Information

• Chemical Name: 2-[(4-Nitrophenyl)carbamoyl]benzoic acid
• CAS No.: 6307-10-4
• Molecular Formula: C14H10 N2 O5
• Molecular Weight: 286.244
• Hs Code.: 2924299090
• European Community (EC) Number: 666-158-3
• NSC Number: 41061
• DSSTox Substance ID: DTXSID20285211
• Wikidata: Q82020505
• Mol file: 6307-10-4.mol

Synonyms:2-[(4-nitrophenyl)carbamoyl]benzoic acid;6307-10-4;4'-Nitrophthalanilic acid;1609-90-1;2-((4-Nitrophenyl)carbamoyl)benzoic acid;Phthalanilic acid, 4'-nitro-;2-(4-NitrophenylcarbaMoyl)benzoic acid, 96per cent;2-(4-nitrophenylaminocarbonyl)benzoic acid;NSC41061;2-(4-Nitrophenylcarbamoyl)benzoic acid;Oprea1_645015;SCHEMBL7821134;DTXSID20285211;NSC-41061;STL257364;AKOS001567983;2-((4-Nitrophenyl)carbamoyl)benzoicacid;SR-01000392377;Benzoic acid, 2-[[(4-nitrophenyl)amino]carbonyl]-;SR-01000392377-1

Chemical Property of 2-[(4-Nitrophenyl)carbamoyl]benzoic acid

Chemical Property:

• Vapor Pressure: 2.13E-08mmHg at 25°C
• Boiling Point: 436.7°C at 760 mmHg
• Flash Point: 217.9°C
• PSA: 112.22000
• Density: 1.485g/cm³
• LogP: 3.14150
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 286.05897142
• Heavy Atom Count: 21
• Complexity: 412

Purity/Quality:

85.0-99.8% ^*data from raw 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)[N+](=O)[O-])C(=O)O

Technology Process of 2-[(4-Nitrophenyl)carbamoyl]benzoic acid

There total 12 articles about 2-[(4-Nitrophenyl)carbamoyl]benzoic acid 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: 97.0%

phthalic anhydride (85-44-9) + 4-nitro-aniline (100-01-6,104810-17-5) → 4-nitrophthalanilic acid (6307-10-4)

Guidance literature:

In chloroform; at 20 ℃; for 50h;

DOI:10.1039/b008399m

Reference yield:

phthalanilic acid (4727-29-1) → 4-nitrophthalanilic acid (6307-10-4)

Guidance literature:

durch Nitrieren;

Reference yield:

2-(4-nitrophenyl)isoindoline-1,3-dione (31604-39-4) → 4-nitrophthalanilic acid (6307-10-4)

Guidance literature:

With sodium carbonate;

upstream raw materials:

phthalic anhydride

4-nitro-aniline

4-nitro-N-(phenylmethylene)benzenamine

phthalanilic acid

Downstream raw materials:

2-(4-nitrophenyl)isoindoline-1,3-dione

N-phenylphthalimide

4-nitro-aniline

benzene-1,2-dicarboxylic acid