CAS 4342-40-9|Hexakis[(2H3)methyl]benzene

Introduction:Basic information about CAS 4342-40-9|Hexakis[(2H3)methyl]benzene, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameHexakis[(2H3)methyl]benzene
CAS Number4342-40-9Molecular Weight180.38200
Density0.867g/cm3Boiling Point/
Molecular FormulaC12D18Melting Point165-167ºC(lit.)
MSDSChineseUSAFlash Point/

Names

Namehexamethylbenzene-d18
SynonymMore Synonyms

Hexakis[(2H3)methyl]benzene BiologicalActivity

DescriptionHexamethylbenzene-d18 is the deuterium labeled Hexamethylbenzene[1].
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.  

Chemical & Physical Properties

Density0.867g/cm3
Melting Point165-167ºC(lit.)
Molecular FormulaC12D18
Molecular Weight180.38200
Exact Mass180.25400
LogP3.53700
Index of Refraction1.501
InChIKeyYUWFEBAXEOLKSG-NBDUPMGQSA-N
SMILESCc1c(C)c(C)c(C)c(C)c1C
Storage condition-20C

Safety Information

RIDADRNONH for all modes of transport

Synonyms

Benzene, 1,2,3,4,5,6-hexa(methyl-d)-
hexamethyl benzene-d18
Hexakis-trideuteriomethyl-benzol
Perdeuterated hexamethylbenzene
Disilane,hexaisocyanato
octadecadeuterio-mellitene
Hexakis[(H)methyl]benzene
hexaisocyanato disilane
hexakis-trideuteriomethyl-benzene
MFCD00144445
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