4-Chloro-3-methylbiphenyl

Base Information

• Chemical Name: 4-Chloro-3-methylbiphenyl
• CAS No.: 19482-09-8
• Molecular Formula: C₁₃H₁₁Cl
• Molecular Weight: 202.683
• DSSTox Substance ID: DTXSID801303807
• Mol file: 19482-09-8.mol

Synonyms:4-chloro-3-methylbiphenyl;19482-09-8;1,1'-Biphenyl, 4-chloro-3-methyl-;SCHEMBL308031;RKCVWQISULVYFX-UHFFFAOYSA-N;DTXSID801303807;1-chloro-2-methyl-4-phenylbenzene;4-Chloro-3-methyl-1,1'-biphenyl;4-Chloro-3-methyl-1,1a(2)-biphenyl

Chemical Property of 4-Chloro-3-methylbiphenyl

Chemical Property:

• Boiling Point: 297.7±9.0 °C(Predicted)
• Density: 1.107±0.06 g/cm3(Predicted)
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 202.0549280
• Heavy Atom Count: 14
• Complexity: 172

Purity/Quality:

95% ^*data from raw suppliers

4-Chloro-3-methylbiphenyl ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

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

Technology Process of 4-Chloro-3-methylbiphenyl

There total 4 articles about 4-Chloro-3-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: 78.0%

1-bromo-4-methoxy-benzene (104-92-7) + 4-chloro-3-methylbenzeneboronic acid (161950-10-3) → 4-Chlor-3-methyl-biphenyl (19482-09-8) + 4,4'-dichloro-3,3'-dimethyl-1,1'-biphenyl (19482-16-7) + 4'-chloro-3'-methyl-1,1'-biphenyl-4-yl methyl ether

Guidance literature:

1-bromo-4-methoxy-benzene; 4-chloro-3-methylbenzeneboronic acid; Pd((PAnPh₂)2Cl₂; With [resin-CH₂N(CH₃)3]2CO₃; In water; N,N-dimethyl-formamide; at 80 ℃; for 16h;

With [resin-CH₂N(CH₃)3]2CO₃; 4-{[(9-anthrylmethyl)amino]carbonyl}phenylboronic acid; In water; N,N-dimethyl-formamide; at 80 ℃;

With maleimido-CH₂-PS resin; In water; N,N-dimethyl-formamide; at 90 ℃; for 10h;

DOI:10.1021/jo035129g

Reference yield: 64.0%

4-Chloro-3-methylphenol (59-50-7) + phenylboronic acid (98-80-6) → 4-Chlor-3-methyl-biphenyl (19482-09-8)

Guidance literature:

4-Chloro-3-methylphenol; With sodium hydride; In tetrahydrofuran; at 20 ℃; for 0.5h;

With 2,2-dichloro-1,3-dicyclohexylimidazolidine-4,5-dione; In tetrahydrofuran; at 20 ℃; for 1h;

phenylboronic acid; With potassium carbonate; In tetrahydrofuran; at 65 ℃; for 24h;

DOI:10.1002/aoc.5383

Reference yield:

2-chloro-5-bromotoluene (54932-72-8) + phenylboronic acid (98-80-6) → 4-Chlor-3-methyl-biphenyl (19482-09-8)

Guidance literature:

With tetrabutylammomium bromide; potassium carbonate; palladium diacetate; In water;

upstream raw materials:

iodobenzene

1-chloro-4-iodo-2-methylbenzene

1-bromo-4-methoxy-benzene

4-chloro-3-methylbenzeneboronic acid