96210-87-6

96210-87-6 structure
96210-87-6 structure
  • Name: bisphenol a-d16
  • Chemical Name: 1,2,4,5-tetradeuterio-3-deuteriooxy-6-[1,1,1,3,3,3-hexadeuterio-2-(2,3,5,6-tetradeuterio-4-deuteriooxyphenyl)propan-2-yl]benzene
  • CAS Number: 96210-87-6
  • Molecular Formula: C15D16O2
  • Molecular Weight: 244.38500
  • Catalog: analytical chemistry Standard Volatile Organic Compounds (VOCs)
  • Create Date: 2018-03-07 08:00:00
  • Modify Date: 2024-01-04 19:27:25
  • Bisphenol A-d16 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].

Name 1,2,4,5-tetradeuterio-3-deuteriooxy-6-[1,1,1,3,3,3-hexadeuterio-2-(2,3,5,6-tetradeuterio-4-deuteriooxyphenyl)propan-2-yl]benzene
Synonyms MFCD00143777
Bisphenol A-d16
Description Bisphenol A-d16 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].
Related Catalog
In Vitro Stable 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 Oct127(1-2):27-34.  

Density 1.224 g/cm3
Boiling Point 220ºC4 mm Hg(lit.)
Melting Point 157-159ºC(lit.)
Molecular Formula C15D16O2
Molecular Weight 244.38500
Flash Point 192.4ºC
Exact Mass 244.21500
PSA 40.46000
LogP 3.42370
Storage condition room temp
Symbol GHS05 GHS07 GHS08
GHS05, GHS07, GHS08
Signal Word Danger
Hazard Statements H317-H318-H335-H361f
Precautionary Statements P280-P305 + P351 + P338 + P310
Hazard Codes Xi: Irritant;Xn: Harmful;
Risk Phrases R36/37/38
Safety Phrases 26-36-46-36/37/39
RIDADR NONH for all modes of transport
WGK Germany 3