CAS 92739-58-7|Bisphenol A-4d

Introduction:Basic information about CAS 92739-58-7|Bisphenol A-4d, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameBisphenol A-4d
CAS Number92739-58-7Molecular Weight236.33600
Density/Boiling Point220ºC4 mm Hg(lit.)
Molecular FormulaC15H8D8O2Melting Point157-159ºC(lit.)
MSDSChineseUSAFlash Point/
Symbol
GHS05, GHS07, GHS08, GHS09
Signal WordDanger

Names

Name2,3,5,6-tetradeuterio-4-[2-(2,3,5,6-tetradeuterio-4-hydroxyphenyl)propan-2-yl]phenol
SynonymMore Synonyms

Bisphenol A-4d BiologicalActivity

DescriptionBisphenol A-d8 is the deuterium labeled Bisphenol A[1]. Bisphenol A is a phenolic, organic synthetic compound widely used in the production of polycarbonate plastics and epoxy resins. Bisphenol A is a reproductive, developmental, and systemic toxicant, often classified as an endocrine-disrupting compound (EDC). Bisphenol A is associated with many diseases, including cardiovascular diseases, respiratory diseases, diabetes, kidney diseases, obesity, and reproductivedisorders[2][3][4].
Related CatalogResearch Areas >>Endocrinology
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]. Huang M, et al. Bisphenol A and its analogues bisphenol S, bisphenol F and bisphenol AF induce oxidative stress and biomacromolecular damage in human granulosa KGN cells. Chemosphere. 2020 Apr 9;253:126707.  

[3]. Rubin BS, et al. Bisphenol A: an endocrine disruptor with widespread exposure and multiple effects. J Steroid Biochem Mol Biol. 2011 Oct;127(1-2):27-34.  

Chemical & Physical Properties

Boiling Point220ºC4 mm Hg(lit.)
Melting Point157-159ºC(lit.)
Molecular FormulaC15H8D8O2
Molecular Weight236.33600
Exact Mass236.16500
PSA40.46000
LogP3.42370
InChIKeyIISBACLAFKSPIT-UWAUJQNOSA-N
SMILESCC(C)(c1ccc(O)cc1)c1ccc(O)cc1

Safety Information

Symbol
GHS05, GHS07, GHS08, GHS09
Signal WordDanger
Hazard StatementsH317-H318-H335-H361f-H411
Precautionary StatementsP280-P305 + P351 + P338 + P310
RIDADRNONH for all modes of transport

Synonyms

2,2-Bis(4-hydroxyphenyl-d4)propane
BisphenolA-(rings-d8)
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