4,4'-([2,2'-Bipyridine]-4,4'-diyl)dibenzoic acid

Base Information

• Chemical Name: 4,4'-([2,2'-Bipyridine]-4,4'-diyl)dibenzoic acid
• CAS No.: 143954-72-7
• Molecular Formula: C24H16N2O4
• Molecular Weight: 396.39500
• DSSTox Substance ID: DTXSID90363919
• Nikkaji Number: J2.935.586J
• Wikidata: Q82147661
• Mol file: 143954-72-7.mol

Synonyms:143954-72-7;4,4'-([2,2'-Bipyridine]-4,4'-diyl)dibenzoic acid;4-[2-[4-(4-carboxyphenyl)pyridin-2-yl]pyridin-4-yl]benzoic Acid;4,4'-(2,2'-BIPYRIDINE-4,4'-DIYL)DIBENZOIC ACID;4,4/'-(2,2/'-Bipyridine-4,4/'-diyl)dibenzoic acid;SCHEMBL6748946;YSZC1499;DTXSID90363919;CS-0170166;4,4'-di (p-carboxyphenyl)-2,2'-bipyridine;F87121;A909146;4,4'-(2,2'-Bipyridine-4,4'-diyl)bisbenzoic acid;4,4'-([2,2'-Bipyridine]-4,4'-diyl)dibenzoicacid;4,4/'-([2,2/'-Bipyridine]-4,4/'-diyl)dibenzoic acid

Chemical Property of 4,4'-([2,2'-Bipyridine]-4,4'-diyl)dibenzoic acid

Chemical Property:

• PSA: 100.38000
• LogP: 4.87400
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 396.11100700
• Heavy Atom Count: 30
• Complexity: 544

Purity/Quality:

97% ^*data from raw suppliers

4,4'-([2,2'-Bipyridine]-4,4'-diyl)dibenzoicacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C2=CC(=NC=C2)C3=NC=CC(=C3)C4=CC=C(C=C4)C(=O)O)C(=O)O

Technology Process of 4,4'-([2,2'-Bipyridine]-4,4'-diyl)dibenzoic acid

There total 2 articles about 4,4'-([2,2'-Bipyridine]-4,4'-diyl)dibenzoic 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: 75.0%

4,4'-di(p-methylphenyl)-2,2'-bipyridine (111971-31-4) → 4,4’-bis(p-carboxyphenyl)-2,2’-bipyridine (143954-72-7)

Guidance literature:

With potassium dichromate; sulfuric acid; water; nitric acid; at 160 ℃; for 36h;

DOI:10.1016/j.tetlet.2010.12.074

Reference yield: 71.0%

4,4'-dibromo-2,2'-bipyridine (18511-71-2) + 4-carboxyphenylboronic acid (14047-29-1) → 4,4’-bis(p-carboxyphenyl)-2,2’-bipyridine (143954-72-7)

Guidance literature:

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; sodium carbonate; In methanol; water; for 72h; Inert atmosphere; Reflux;

DOI:10.1021/acs.cgd.8b00130

Reference yield: 73.0%

platinum(II) cyanide + 4,4’-bis(p-carboxyphenyl)-2,2’-bipyridine (143954-72-7) → [Pt(CN)2(4,4′-di(pcarboxyphenyl)-2,2′-bipyridine)]·9H2O

Guidance literature:

With ammonia; In water; at 100 ℃; for 48h;

DOI:10.1021/acs.cgd.8b00130

upstream raw materials:

4,4'-di(p-methylphenyl)-2,2'-bipyridine

4,4'-dibromo-2,2'-bipyridine

4-carboxyphenylboronic acid

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