5-Bromo-2-(phenylamino)benzoic acid

Base Information

• Chemical Name: 5-Bromo-2-(phenylamino)benzoic acid
• CAS No.: 82762-60-5
• Molecular Formula: C13H10 Br N O2
• Molecular Weight: 292.132
• Hs Code.: 2922499990
• DSSTox Substance ID: DTXSID30513138
• Nikkaji Number: J2.446.295A
• Wikidata: Q82372764
• Mol file: 82762-60-5.mol

Synonyms:82762-60-5;5-Bromo-2-(phenylamino)benzoic acid;2-Anilino-5-bromobenzoic acid;5-BROMO-2-PHENYLAMINO-BENZOIC ACID;DTXSID30513138;AKOS015964560;FT-0747474

Chemical Property of 5-Bromo-2-(phenylamino)benzoic acid

Chemical Property:

• Vapor Pressure: 8.96E-08mmHg at 25°C
• Refractive Index: 1.688
• Boiling Point: 419.1°C at 760 mmHg
• Flash Point: 207.3°C
• PSA: 49.33000
• Density: 1.586g/cm³
• LogP: 3.96390
• XLogP3: 5.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 290.98949
• Heavy Atom Count: 17
• Complexity: 266

Purity/Quality:

98% ^*data from raw suppliers

5-Bromo-2-(phenylamino)benzoicacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)NC2=C(C=C(C=C2)Br)C(=O)O

Technology Process of 5-Bromo-2-(phenylamino)benzoic acid

There total 4 articles about 5-Bromo-2-(phenylamino)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: 96.0%

2,5-dibromobenzoic acid (610-71-9) + aniline (62-53-3) → N-phenyl-5-bromoanthranilic acid (82762-60-5)

Guidance literature:

With potassium carbonate; copper(II) oxide; at 130 ℃; for 3h;

Reference yield: 96.0%

5-bromo-2-iodo-benzoic acid (21740-00-1) + aniline (62-53-3) → N-phenyl-5-bromoanthranilic acid (82762-60-5)

Guidance literature:

With potassium carbonate; CuPy₂Cl₂; at 75 ℃; for 0.333333h; microwave irradiation;

DOI:10.3184/030823407X255597

Reference yield: 79.0%

5-bromo-2-chlorobenzoic acid (21739-92-4) + aniline (62-53-3) → N-phenyl-5-bromoanthranilic acid (82762-60-5)

Guidance literature:

With potassium carbonate; CuPy₂Cl₂; at 75 ℃; for 0.333333h; microwave irradiation;

DOI:10.3184/030823407X255597

upstream raw materials:

2,5-dibromobenzoic acid

aniline

5-Bromo-2-aminobenzoic acid

5-bromo-2-chlorobenzoic acid

Downstream raw materials:

5-Bromo-N-(2',4'-dibromophenyl)anthranilic acid

C₁₅H₁₄BrNO₂

C₁₄H₁₂BrNO

C₁₄H₁₄BrNO