Equilenin-4,16,16-d3

Modify Date: 2024-02-25 17:44:10

Equilenin-4,16,16-d3 Structure
Equilenin-4,16,16-d3 structure
Common Name Equilenin-4,16,16-d3
CAS Number 56588-54-6 Molecular Weight 269.35
Density 1.2±0.1 g/cm3 Boiling Point 472.6±45.0 °C at 760 mmHg
Molecular Formula C18H15D3O2 Melting Point N/A
MSDS N/A Flash Point 200.9±21.3 °C

 Use of Equilenin-4,16,16-d3


Equilenin-4,16,16-d3 is the deuterium labeled Equilenin-4,16,16.

 Names

Name (13S,14S)-4,16,16-trideuterio-3-hydroxy-13-methyl-11,12,14,15-tetrahydrocyclopenta[a]phenanthren-17-one
Synonym More Synonyms

 Equilenin-4,16,16-d3 Biological Activity

Description Equilenin-4,16,16-d3 is the deuterium labeled Equilenin-4,16,16.
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;53(2):211-216.

 Chemical & Physical Properties

Density 1.2±0.1 g/cm3
Boiling Point 472.6±45.0 °C at 760 mmHg
Molecular Formula C18H15D3O2
Molecular Weight 269.35
Flash Point 200.9±21.3 °C
Exact Mass 269.149506
PSA 37.30000
LogP 3.76
Vapour Pressure 0.0±1.2 mmHg at 25°C
Index of Refraction 1.663

 Synonyms

3-Hydroxy(4,16,16-H)estra-1(10),2,4,6,8-pentaen-17-one
4,16,16-Trideuteroequilenin
Equilenin-d3
Estra-1(10),2,4,6,8-pentaen-17-one-4,16,16-d, 3-hydroxy-
E 400-d3
Equilenine-d3
d-Equilenin-d3
3-Hydroxyestra-1,3,5,7,9-pentaen-17-one-d3