CAS 352439-00-0|Sodium 3-hydroxy(2,2-2H2)butanoate

Introduction:Basic information about CAS 352439-00-0|Sodium 3-hydroxy(2,2-2H2)butanoate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameSodium 3-hydroxy(2,2-2H2)butanoate
CAS Number352439-00-0Molecular Weight128.099
Density/Boiling Point/
Molecular FormulaC4H5D2NaO3Melting Point/
MSDS/Flash Point/

Names

Namesodium 3-hydroxybutyrate-2,2-d2
SynonymMore Synonyms

Sodium 3-hydroxy(2,2-2H2)butanoate BiologicalActivity

Description3-Hydroxybutyric acid-d2 (sodium) is the deuterium labeled 3-Hydroxybutyric acid sodium[1]. 3-Hydroxybutyric acid sodium (β-Hydroxybutyric acid sodium) is a metabolite that is elevated in type I diabetes. 3-Hydroxybutyric acid sodium can modulate the properties of membrane lipids[2].
Related CatalogResearch Areas >>Metabolic Disease
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]. Hsu TT, et al. 3-Hydroxybutyric acid interacts with lipid monolayers at concentrations that impair consciousness. Langmuir. 2013 Feb 12;29(6):1948-55.  

Chemical & Physical Properties

Molecular FormulaC4H5D2NaO3
Molecular Weight128.099
Exact Mass128.041840
PSA60.36000
InChIKeyNBPUSGBJDWCHKC-IYPYQTRPSA-M
SMILESCC(O)CC(=O)[O-].[Na+]

Synonyms

sodium dl-3-hydroxybutyrate-2,2-d2
Sodium 3-hydroxy(2,2-H)butanoate
Butanoic-2,2-d acid, 3-hydroxy-, sodium salt (1:1)
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