CAS 3855-82-1|1,4-Dichloro(2H4)benzene

Introduction:Basic information about CAS 3855-82-1|1,4-Dichloro(2H4)benzene, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name1,4-Dichloro(2H4)benzene
CAS Number3855-82-1Molecular Weight151.027
Density1.3±0.1 g/cm3Boiling Point174.1±0.0 °C at 760 mmHg
Molecular FormulaC6Cl2D4Melting Point52-54ºC(lit.)
MSDSChineseUSAFlash Point65.6±0.0 °C
Symbol
GHS07, GHS08, GHS09
Signal WordWarning

Names

Name1,4-Dichlorobenzene-d4
SynonymMore Synonyms

1,4-Dichloro(2H4)benzene BiologicalActivity

Description1,4-Dichlorobenzene-d4 is the deuterium labeled 1,4-Dichlorobenzene[1]. 1,4-Dichlorobenzene is used as an intermediate product in the manufacture of pigments, pesticides and disinfectants. 1,4-Dichlorobenzene is also employed as a moth control agent[2].
Related CatalogResearch Areas >>OthersSignaling Pathways >>Others >>Others
In VitroStable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and metabolic profiles of drugs[1].
References

[1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53(2):211-216.  

[2]. M. Tschickardt. Dichlorobenzene isomers (1,2-dichlorobenzene, 1,3-dichlorobenzene and 1,4 dichlorobenzene).

Chemical & Physical Properties

Density1.3±0.1 g/cm3
Boiling Point174.1±0.0 °C at 760 mmHg
Melting Point52-54ºC(lit.)
Molecular FormulaC6Cl2D4
Molecular Weight151.027
Flash Point65.6±0.0 °C
Exact Mass149.994110
LogP3.34
Vapour Pressure1.6±0.3 mmHg at 25°C
Index of Refraction1.549
InChIKeyOCJBOOLMMGQPQU-RHQRLBAQSA-N
SMILESClc1ccc(Cl)cc1
Storage condition0-6°C

Safety Information

Symbol
GHS07, GHS08, GHS09
Signal WordWarning
Hazard StatementsH319-H351-H410
Precautionary StatementsP280-P305 + P351 + P338
Target OrgansBlood, Central nervous system, Liver
Personal Protective EquipmentEyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
Hazard CodesXn: Harmful;N: Dangerous for the environment;
Risk PhrasesR36
Safety Phrases36/37-46-60-61-45-24/25-23
RIDADRUN 3077 9
WGK Germany3
Packaging GroupIII

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Synonyms

1,4-dichloro-2,3,5,6-tetradeuteriobenzene
MFCD00000605
1,4-Dichloro(H)benzene
Tetradeutero-1,4-dichlorobenzene
1,4-Dichloro-2,3,5,6-tetradeuterobenzene
Benzene-1,2,4,5-d, 3,6-dichloro-
CAS 3853-80-3|(+/-)-1-PHENYL-3-AZABICYCLO[3.1.0]HEXANE
CAS 38574-14-0|1,3,5-trimethylbenzene-2,4,6-d3
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