1,2-Dichloro-4-(1-chloroethyl)benzene

Base Information

• Chemical Name: 1,2-Dichloro-4-(1-chloroethyl)benzene
• CAS No.: 54965-01-4
• Molecular Formula: C8H7 Cl3
• Molecular Weight: 209.503
• Hs Code.: 2903999090
• European Community (EC) Number: 259-413-1
• DSSTox Substance ID: DTXSID60970311
• Nikkaji Number: J101.785C
• Mol file: 54965-01-4.mol

Synonyms:1,2-Dichloro-4-(1-chloroethyl)benzene;54965-01-4;Benzene, 1,2-dichloro-4-(1-chloroethyl)-;EINECS 259-413-1;SCHEMBL10867874;DTXSID60970311;AKOS009236980;alpha-Methyl-3,4-dichlorobenzyl chloride;3,4-Dichloro-.alpha.-methylbenzylchloride;.alpha.-Methyl-3,4-dichlorobenzyl chloride;1,2-Dichloro-4-(1-chloroethyl)benzene #;EN300-258373

Chemical Property of 1,2-Dichloro-4-(1-chloroethyl)benzene

Chemical Property:

• Vapor Pressure: 0.027mmHg at 25°C
• Boiling Point: 254.8°C at 760 mmHg
• Flash Point: 163.6°C
• PSA: 0.00000
• Density: 1.323g/cm³
• LogP: 4.29320
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 207.961333
• Heavy Atom Count: 11
• Complexity: 127

Purity/Quality:

99% ^*data from raw suppliers

1,2-dichloro-4-(1-chloroethyl)benzene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 1,2-Dichloro-4-(1-chloroethyl)benzene

There total 4 articles about 1,2-Dichloro-4-(1-chloroethyl)benzene 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:

1,2-dichloro-benzene (95-50-1) → 1,2-dichloro-4-(1-chloroethyl)benzene (54965-01-4)

Guidance literature:

Multi-step reaction with 2 steps

1: AlCl₃

2: Irradiation_.Einleiten von Chlor

With aluminium trichloride;

DOI:10.1021/ja01209a045

Reference yield:

1,2-dichloro-4-ethylbenzene (6623-59-2) → 1,2-dichloro-4-(1-chloroethyl)benzene (54965-01-4)

Guidance literature:

Irradiation_.Einleiten von Chlor;

DOI:10.1021/ja01209a045

Reference yield:

→ 1,2-dichloro-4-(1-chloroethyl)benzene (54965-01-4)

Guidance literature:

With thionyl chloride; In dichloromethane; at 0 ℃; for 1h; Reflux;

upstream raw materials:

1,2-dichloro-4-ethylbenzene

1,2-dichloro-benzene

Downstream raw materials:

1-[1-(3,4-dichloro-phenyl)-ethyl]-1H-imidazole-4,5-dicarbonitrile

C₂₃H₂₅Cl₂N₃O₃