4-Iodo-4'-methylbiphenyl

Base Information

• Chemical Name: 4-Iodo-4'-methylbiphenyl
• CAS No.: 55290-86-3
• Molecular Formula: C13H11I
• Molecular Weight: 294.135
• Hs Code.: 2903999090
• DSSTox Substance ID: DTXSID00568190
• Nikkaji Number: J724.543B
• Wikidata: Q72483907
• Mol file: 55290-86-3.mol

Synonyms:4-Iodo-4'-methylbiphenyl;55290-86-3;4-Iodo-4'-methyl-1,1'-biphenyl;1-iodo-4-(4-methylphenyl)benzene;MFCD00457077;C13H11I;SCHEMBL4392845;DTXSID00568190;4'-IODO-4-METHYL-BIPHENYL;CX1115;AKOS015853625;AC-26577;SY041372;A8007;CS-0172129;4-Iodo-4 inverted exclamation mark -methylbiphenyl;J-515562

Chemical Property of 4-Iodo-4'-methylbiphenyl

Chemical Property:

• Boiling Point: 335.6 °C at 760 mmHg
• Flash Point: 151.9 °C
• PSA: 0.00000
• Density: 1.523 g/cm³
• LogP: 4.26660
• Storage Temp.: 2-8°C
• XLogP3: 5.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 293.99055
• Heavy Atom Count: 14
• Complexity: 162

Purity/Quality:

98%,99%, ^*data from raw suppliers

4-Iodo-4''-methylbiphenyl ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C2=CC=C(C=C2)I

Technology Process of 4-Iodo-4'-methylbiphenyl

There total 1 articles about 4-Iodo-4'-methylbiphenyl 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: 79.0%

para-diiodobenzene (624-38-4,1032416-46-8) + 4-methylphenylboronic acid (5720-05-8) → 1,4-bis(4-methylphenyl)benzene + 4-iodo-4'-methylbiphenyl (55290-86-3)

Guidance literature:

With potassium phosphate; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; tri-tert-butyl phosphine; In tetrahydrofuran; at 60 ℃; for 6h;

DOI:10.1021/ja052547p

Reference yield: 88.0%

4-iodo-4'-methylbiphenyl (55290-86-3) → 4-(4-methylphenyl)aniline (1204-78-0)

Guidance literature:

With ammonium hydroxide; caesium carbonate; In water; for 4h; Catalytic behavior; Reflux;

DOI:10.1007/s10562-018-2567-1

Reference yield: 49.6%

di-p-tolylamine (620-93-9) + 4-iodo-4'-methylbiphenyl (55290-86-3) → (4'-methyl-biphenyl-4-yl)-di-p-tolyl-amine

Guidance literature:

With copper; potassium carbonate; In nitrobenzene; at 205 - 208 ℃; for 11h;

DOI:10.1246/bcsj.73.785

upstream raw materials:

para-diiodobenzene

4-methylphenylboronic acid

Downstream raw materials:

4,4'''-dimethyl-[1,1';4',1'';4'',1''']quaterphenyl

4-Methylbiphenyl

N,N-di(4'-methyl-4-biphenyl)benzylamine

2-(p-tolyl)-9H-fluoren-9-one

Refernces