3-Chloro-2-methylbiphenyl

Base Information

• Chemical Name: 3-Chloro-2-methylbiphenyl
• CAS No.: 20261-24-9
• Molecular Formula: C13H11Cl
• Molecular Weight: 202.683
• Hs Code.: 2903999090
• DSSTox Substance ID: DTXSID70404753
• Nikkaji Number: J282.362D
• Wikidata: Q82209076
• Mol file: 20261-24-9.mol

Synonyms:3-Chloro-2-methylbiphenyl;20261-24-9;1-chloro-2-methyl-3-phenylbenzene;3-chloro-2-methyl-1,1'-biphenyl;1,1'-Biphenyl, 3-chloro-2-methyl-;3-Chloro-2-methyl biphenyl;starbld0000273;3-cloro-2-methyl-biphenyl;SCHEMBL5373779;3-Chloro-2-methylbiphenyl,96%;AMY8734;DTXSID70404753;JNXJARJANRFDKX-UHFFFAOYSA-N;3-Chloro-2-methylbiphenyl, 96%;3-chloro-2-methyl[1,1'-biphenyl];3-chloro-2-methyl-[1,1'-biphenyl];AKOS015916538;3-chloro-2-methyl-[ 1,1'-biphenyl];CS-0145527;FT-0692103

Chemical Property of 3-Chloro-2-methylbiphenyl

Chemical Property:

• Vapor Pressure: 0.00161mmHg at 25°C
• Melting Point: 43°C (estimate)
• Refractive Index: n20/D 1.601(lit.)
• Boiling Point: 102-105oC0.65 mm Hg(lit.)
• Flash Point: >230 °F
• PSA: 0.00000
• Density: 1.137 g/mL at 25oC(lit.)
• LogP: 4.31540
• XLogP3: 4.9
• 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:

98%Min ^*data from raw suppliers

3-Chloro-2-methylbiphenyl 96% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CC=C1Cl)C2=CC=CC=C2

Technology Process of 3-Chloro-2-methylbiphenyl

There total 1 articles about 3-Chloro-2-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:

4-chloro-2-methylbiphenyl (5002-14-2) → cyclohexylcyclohexane (92-51-3) + 2-methylbiphenyl (643-58-3) + 3-chloro-2-methyl-[1,1'-biphenyl] (20261-24-9)

Guidance literature:

In cyclohexane; Product distribution; Quantum yield; Irradiation;

Reference yield: 95.0%

3-chloro-2-methyl-[1,1'-biphenyl] (20261-24-9) + 1-phenyl-propan-1-one (93-55-0) → 2-(2-methyl-3-phenylphenyl)-1-phenylpropan-1-one

Guidance literature:

With dichloro(1,5-cyclooctadiene)palladium(II); keYPhos; sodium t-butanolate; In tetrahydrofuran; at 20 ℃; for 16h; Inert atmosphere; Glovebox;

DOI:10.1021/acs.orglett.9b02830

Reference yield: 90.0%

3-chloro-2-methyl-[1,1'-biphenyl] (20261-24-9) + bis(pinacol)diborane (73183-34-3) → 4,4,5,5-tetramethyl-2-(2-methyl[1,1'-biphenyl]-3-yl)-1,3,2-dioxaborolane

Guidance literature:

With dicyclohexyl-(2',6'-dimethoxybiphenyl-2-yl)-phosphane; potassium phosphate; palladium diacetate; In 1,4-dioxane; at 20 ℃; for 48h; Inert atmosphere;

upstream raw materials:

4-chloro-2-methylbiphenyl

Downstream raw materials:

cyclohexylcyclohexane

4-chloro-2-methylbiphenyl

2-methylbiphenyl

2-(2-methyl-1,1'-biphenyl-3-yl)naphthalene

Refernces