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Merck
CN

D56829

1,4-Dichlorobenzene

≥99%

Synonym(s):

1,4-Dichlorobenzene, Di-chloricide, Dichlorocide, PDB, Paradichlorobenzene, p-Chlorophenyl chloride, p-Dichlorobenzene, para-Dichlorobenzene

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About This Item

Empirical Formula (Hill Notation):
C6H4Cl2
CAS Number:
106-46-7
Molecular Weight:
147.00
Beilstein:
1680023
EC Number:
203-400-5
MDL number:
MFCD00000604
UNSPSC Code:
12352100
PubChem Substance ID:
24893960
NACRES:
NA.22
Assay:
≥99%
Bp:
173 °C (lit.)
Vapor pressure:
1.03 mmHg ( 25 °C)

Key Documents

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vapor density

5.07 (vs air)

Quality Level

100

vapor pressure

1.03 mmHg ( 25 °C)

Assay

≥99%

form

crystalline solid

bp

173 °C (lit.)

mp

52-54 °C (lit.)

density

1.241 g/mL at 25 °C (lit.)

SMILES string

Clc1ccc(Cl)cc1

InChI

1S/C6H4Cl2/c7-5-1-2-6(8)4-3-5/h1-4H

InChI key

OCJBOOLMMGQPQU-UHFFFAOYSA-N

Gene Information

human ... CYP2A6(1548)
mouse ... Cyp2a5(13087)

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Application

1,4-Dichlorobenzene can be used as a reactant:
  • In the synthesis of nitro-aromatics via electrophilic nitration.
  • To synthesize polyarylbenzenes through C-C cross coupling with arylboronic acids using imidazolium salt as a catalyst.
  • In the Pd-catalyzed Mizoroki-Heck coupling reaction with alkenes.

Signal Word

Warning

Hazard Statements

H319,H351,H410

Hazard Classifications

Aquatic Acute 1 - Aquatic Chronic 1 - Carc. 2 - Eye Irrit. 2

Storage Class Code

11 - Combustible Solids

WGK

WGK 2

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
SDBB2571
MKBS7929V
MKBS4401V
MKBS1350V
MKBR7439V

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Ilknur Hatice Eryilmaz et al.
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Environmental health perspectives, 117(5), 790-796 (2009-05-30)
Ambient measurements of hazardous air pollutants (air toxics) have been used to validate model-predicted concentrations of air toxics but have not been used to perform risk screening at the national level. We used ambient concentrations of routinely measured air toxics
Osamu Takahashi et al.
Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association, 49(1), 49-56 (2010-10-12)
Rats and mice (8 animals per species per group) were injected subcutaneously or intraperitoneally with paradichlorobenzene (PDCB) at doses of 0, 100, 200 and 400 mg/kg/day, 4-5 days a week, for 8 weeks (for rats) and either 2 or 6
Bernhard Rainer et al.
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International journal of environmental research and public health, 15(4) (2018-04-14)
The inhalation of a water aerosol from a humidifier containing disinfectants has led to serious lung injuries in Korea. To promote the safe use of products, the Korean government enacted regulations on the chemicals in various consumer products that could
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