2-((4-Ethoxyphenyl)amino)-4-nitrobenzoic acid

Base Information

• Chemical Name: 2-((4-Ethoxyphenyl)amino)-4-nitrobenzoic acid
• CAS No.: 74859-51-1
• Molecular Formula: C15H14 N2 O5
• Molecular Weight: 302.287
• Hs Code.: 2922509090
• European Community (EC) Number: 654-698-2
• NSC Number: 163287
• DSSTox Substance ID: DTXSID90303890
• Wikidata: Q82049384
• Mol file: 74859-51-1.mol

Synonyms:74859-51-1;2-((4-ETHOXYPHENYL)AMINO)-4-NITROBENZOIC ACID;2-(4-ethoxyanilino)-4-nitrobenzoic acid;2-[(4-ethoxyphenyl)amino]-4-nitrobenzoic acid;2-((4-Ethoxyphenyl)amino)-4-nitrobenzoicacid;Benzoic acid, 2-[(4-ethoxyphenyl)amino]-4-nitro-;NSC163287;SCHEMBL7921359;DTXSID90303890;MFCD00024723;AKOS003388540;NSC-163287;LS-08833;CS-0319465;F18000;2-[(4-ethoxyphenyl)amino]-4-nitro-benzoic acid;A838244

Chemical Property of 2-((4-Ethoxyphenyl)amino)-4-nitrobenzoic acid

Chemical Property:

• Vapor Pressure: 5.43E-10mmHg at 25°C
• Boiling Point: 479.2°C at 760 mmHg
• Flash Point: 243.6°C
• PSA: 104.38000
• Density: 1.371g/cm³
• LogP: 4.03150
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 302.09027155
• Heavy Atom Count: 22
• Complexity: 390

Purity/Quality:

99% ^*data from raw suppliers

N-(4-ETHOXYPHENYL)-4-NITROANTHRANILIC ACID Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1=CC=C(C=C1)NC2=C(C=CC(=C2)[N+](=O)[O-])C(=O)O

Technology Process of 2-((4-Ethoxyphenyl)amino)-4-nitrobenzoic acid

There total 4 articles about 2-((4-Ethoxyphenyl)amino)-4-nitrobenzoic 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: 74.7%

2-chloro-4-nitrobenzoic acid (99-60-5) + 2-chloro-4-nitrobenzoic acid sodium salt (51282-79-2) + 4-Ethoxyaniline (156-43-4) → Anthranilic acid (74859-51-1)

Guidance literature:

With bis(N-salicylaldimino) Co(II); sodium carbonate; In water; at 75 - 85 ℃; for 4.5h; Product distribution; var. copper(II) containing homogeneous and heterogeneous catalysts;

Reference yield: 62.0%

2-chloro-4-nitrobenzoic acid (99-60-5) + 4-Ethoxyaniline (156-43-4) → Anthranilic acid (74859-51-1)

Guidance literature:

With copper(I) oxide; copper; potassium carbonate; In 2-ethoxy-ethanol; Inert atmosphere; Reflux;

DOI:10.1016/j.bmc.2017.05.034

Reference yield:

4-Ethoxyaniline (156-43-4) → Anthranilic acid (74859-51-1)

Guidance literature:

With copper; sodium carbonate; butan-1-ol;

upstream raw materials:

2-chloro-4-nitrobenzoic acid

4-Ethoxyaniline

2-chloro-4-nitrobenzoic acid sodium salt

Downstream raw materials:

9-chloro-2-ethoxy-6-nitro-acridine

Refernces

• 1、 Zefirov, N. S.,Tyulyaev, I. I.,Panova, G. V.,Baranova, Yu. G.,Dybailo, G. V.,Ivanova, G. B.. "APPLICATION OF CERTAIN COPPER COMPOUNDS AS CATALYSTS IN SYNTHESIS OF N-(4-ETHOXYPHENYL)-4-NITROANTHRANILIC ACID". . p. 1546 - 1549. Retrieved 2007/10/02.