1-Chloro-3-(chlorophenylmethyl)benzene

Base Information

Chemical Name:1-Chloro-3-(chlorophenylmethyl)benzene
CAS No.:13391-39-4
Molecular Formula:C13H10 Cl2
Molecular Weight:237.128
Hs Code.:2903999090
European Community (EC) Number:236-470-0
DSSTox Substance ID:DTXSID80928339
Nikkaji Number:J213.894H
Mol file:13391-39-4.mol

Synonyms:13391-39-4;1-chloro-3-[chloro(phenyl)methyl]benzene;1-Chloro-3-(chlorophenylmethyl)benzene;EINECS 236-470-0;1-chloro-3-(chloro(phenyl)methyl)benzene;SCHEMBL15536895;DTXSID80928339;1-Chloro-3-[(chloro)phenylmethyl]benzene;FT-0759220

Suppliers and Price of 1-Chloro-3-(chlorophenylmethyl)benzene

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 9 raw suppliers

Chemical Property of 1-Chloro-3-(chlorophenylmethyl)benzene

Chemical Property:

Vapor Pressure:0.000618mmHg at 25°C
Boiling Point:319.8°C at 760 mmHg
Flash Point:140°C
PSA：0.00000
Density:1.229g/cm³
LogP:4.66820
XLogP3:5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:0
Rotatable Bond Count:2
Exact Mass:236.0159557
Heavy Atom Count:15
Complexity:187

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)C(C2=CC(=CC=C2)Cl)Cl
Uses 1-Chloro-3-(chloro(phenyl)methyl)benzene is an intermediate for the synthesis of Cetirizine 3-Chloro Impurity Dihydrochloride (C364845). Cetirizine (C281100) impurity as histamine inhibitor agent.

Technology Process of 1-Chloro-3-(chlorophenylmethyl)benzene

There total 7 articles about 1-Chloro-3-(chlorophenylmethyl)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: 86.0%

: 63012-03-3
3-chlorobenzhydrol

: 13391-39-4
3-chlorobenzhydryl chloride

Guidance literature:: With thionyl chloride; In dichloromethane; at 0 ℃; for 2h;
DOI:10.1002/chem.200500845

Reference yield:

: 13391-39-4
3-chlorobenzhydryl chloride

Guidance literature:: With pyridine; thionyl chloride;
DOI:10.1021/ja01134a054

Reference yield:

: 108-86-1,52753-63-6
bromobenzene

: 13391-39-4
3-chlorobenzhydryl chloride

Guidance literature:: Multi-step reaction with 3 steps

1.1: Mg / tetrahydrofuran / Heating

1.2: tetrahydrofuran / 2 h / 20 °C

2.1: 27.5 g / NaBH₄ / ethanol / 12 h / 20 °C

3.1: 86 percent / SOCl₂ / CH₂Cl₂ / 2 h / 0 °C

With sodium tetrahydroborate; thionyl chloride; magnesium; In tetrahydrofuran; ethanol; dichloromethane;
DOI:10.1002/chem.200500845