5-(4-Bromophenyl)-2,2'-bipyridine

Base Information

• Chemical Name: 5-(4-Bromophenyl)-2,2'-bipyridine
• CAS No.: 173960-45-7
• Molecular Formula: C16H11BrN2
• Molecular Weight: 311.181
• Hs Code.: 2933399090
• ChEMBL ID: CHEMBL430467
• DSSTox Substance ID: DTXSID60479657
• Nikkaji Number: J2.143.638K
• Wikidata: Q82313802
• Mol file: 173960-45-7.mol

Synonyms:5-(4-BROMOPHENYL)-2,2'-BIPYRIDINE;173960-45-7;5-(4-Bromophenyl)-2,2/'-bipyridine;5-(4-bromophenyl)-2-pyridin-2-ylpyridine;2,2'-Bipyridine, 5-(4-bromophenyl)-;CHEMBL430467;SCHEMBL23331923;DTXSID60479657;CS-0203046

Chemical Property of 5-(4-Bromophenyl)-2,2'-bipyridine

Chemical Property:

• PSA: 25.78000
• LogP: 4.57310
• Storage Temp.: 2-8°C
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 310.01056
• Heavy Atom Count: 19
• Complexity: 276

Purity/Quality:

97% ^*data from raw suppliers

5-(4-Bromophenyl)-2,2'-bipyridine 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=NC(=C1)C2=NC=C(C=C2)C3=CC=C(C=C3)Br

Technology Process of 5-(4-Bromophenyl)-2,2'-bipyridine

There total 2 articles about 5-(4-Bromophenyl)-2,2'-bipyridine 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: 89.0%

bicyclo[2.2.1]hepta-2,5-diene (121-46-0) + 6-(4-bromophenyl)-3-(2-pyridyl)-1,2,4-triazine (850089-99-5) → 5-(4-bromophenyl)-2,2'-bipyridine (173960-45-7)

Guidance literature:

In o-xylene; for 24h; Heating;

DOI:10.1016/j.tet.2008.06.040

Reference yield: 59.0%

5-bromo-2,2'-bipyridyl (15862-19-8) + 4-Bromophenylboronic acid (5467-74-3) → 5-(4-bromophenyl)-2,2'-bipyridine (173960-45-7)

Guidance literature:

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; potassium carbonate; In N,N-dimethyl-formamide; at 100 ℃; for 8h;

DOI:10.1002/ejic.200700030

Reference yield: 98.0%

potassium hexafluorophosphate (17084-13-8) + [iridium(III)(μ-chloro)(2-phenylpyridine)2]2 + 5-(4-bromophenyl)-2,2'-bipyridine (173960-45-7) → [Ir(ppy)2(bpbpy)]PF6

Guidance literature:

In methanol; dichloromethane; at 20 ℃; for 6h;

DOI:10.1016/j.dyepig.2020.108428

upstream raw materials:

bicyclo[2.2.1]hepta-2,5-diene

6-(4-bromophenyl)-3-(2-pyridyl)-1,2,4-triazine

5-bromo-2,2'-bipyridyl

4-Bromophenylboronic acid

Downstream raw materials:

5-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-2,2’-bipyridine

5-(4-(17α-ethynylestradiolyl)phenyl)-2,2'-bipyridine

9-benzyl-8-[4-(2,2'-bipyridine-5-yl)phenyl]adenine

5-(4-(3-ethoxynaphthalen-2-yl)-phenyl)-2,2'-bipyridine

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