ChemicalBook--->CAS DataBase List--->6842-62-2

6842-62-2

6842-62-2 Structure

6842-62-2 Structure
IdentificationMore
[Name]

3,4'-Dichlorodiphenyl ether
[CAS]

6842-62-2
[Synonyms]

1-chloro-3-(4-chlorophenoxy)-benzene
3,4'-Dichlorodiphenyl ether
3,4-Dichlorphenylether
3,4''-DICHLORODIPHENYL ETHER,99+%
3,4'-Dichlorodiphenyl ether
3-Chlorophenyl 4-chlorophenyl ether
BDE-13
[Molecular Formula]

C12H8Cl2O
[MDL Number]

MFCD00043876
[Molecular Weight]

239.1
[MOL File]

6842-62-2.mol
Chemical PropertiesBack Directory
[Melting point ]

-10 °C
[Boiling point ]

113°C (0.5 mmHg)
[density ]

1.29
[refractive index ]

1.5950
[storage temp. ]

Sealed in dry,Room Temperature
[InChI]

InChI=1S/C12H8Cl2O/c13-9-4-6-11(7-5-9)15-12-3-1-2-10(14)8-12/h1-8H
[InChIKey]

HPRGYUWRGCTBAV-UHFFFAOYSA-N
[SMILES]

C1(Cl)=CC=CC(OC2=CC=C(Cl)C=C2)=C1
[CAS DataBase Reference]

6842-62-2(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H319
[Precautionary statements ]

P305+P351+P338
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Chlorobenzene-->4-Chlorophenol-->C. I. Pigment Blue 30 (77420)-->1-Methylpyrrole-->ALPHA-PYRIDOIN-->3-Chlorophenol-->4-Chlorophenylboronic acid-->1,3-Dichlorobenzene-->IONIC LIQUID
[Preparation Products]

4-(4-CHLOROPHENOXY)-2 CHLORO PHENYL ETHANONE-->1-[2-Chloro-4-(4-chlorophenoxy)phenyl]ethan-1-one
Hazard InformationBack Directory
[Chemical Properties]

Colorless or light yellow oily liquid
[Synthesis]

4-Chlorophenol

106-48-9

1,3-Dichlorobenzene

541-73-1

3,4'-Dichlorodiphenyl ether

6842-62-2

The general steps for synthesizing 3,4'-dichlorodiphenyl ether from p-chlorophenol and 1,3-dichlorobenzene are as follows: first, the organic solvent was prepared by mixing ionic liquid with dipropylene glycol methyl ethyl ether in a mass ratio of 1:20. The specific synthesis method is as follows: (1) A copper salt catalyst is added to the reaction system, while 1,3-dichlorobenzene, p-chlorophenol, a base and the organic solvent prepared above are mixed. Among them, the molar ratio of 1,3-dichlorobenzene, p-chlorophenol, potassium carbonate base and cuprous chloride salt was 6:1:1.2:0.01, and the total dosage of organic solvent was 10% of the total amount of the reactants; (2) under microwave-catalyzed conditions, the reaction mixture was stirred for 2 hours at 500 W power, and the temperature of the reaction was controlled at 60~110°C. The reaction temperature was controlled at 60~110°C. The reaction temperature was set to 0.01 °C for 2 hours. After the reaction was completed, the mixture was left to cool, filtered, and the filtrate was distilled under reduced pressure to collect a colorless and transparent liquid product. The conversion of the method was 99% and the yield was 93%.

[References]

[1] Patent: CN105198713, 2017, B. Location in patent: Paragraph 0024-0044
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