CAS 59060-36-5|3-Hydroxy-3-(2H3)methylpentanedioic acid

Introduction:Basic information about CAS 59060-36-5|3-Hydroxy-3-(2H3)methylpentanedioic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name3-Hydroxy-3-(2H3)methylpentanedioic acid
CAS Number59060-36-5Molecular Weight165.159
Density1.4±0.1 g/cm3Boiling Point354.3±32.0 °C at 760 mmHg
Molecular FormulaC6H7D3O5Melting Point/
MSDSUSAFlash Point182.2±21.6 °C

Names

Name3-hydroxy-3-methyl-d3-pentanedioic acid
SynonymMore Synonyms

3-Hydroxy-3-(2H3)methylpentanedioic acid BiologicalActivity

DescriptionMeglutol-d3 is the deuterium labeled Meglutol[1]. Meglutol is an antilipemic agent which lowers cholesterol, triglycerides, serum beta-lipoproteins and phospholipids, and inhibits the activity of hydroxymethylglutarryl CoA reductases, which is the rate limiting enzyme in the biosynthesis of cholesterol.
Related CatalogResearch Areas >>Cardiovascular DiseaseSignaling Pathways >>Metabolic Enzyme/Protease >>HMG-CoA Reductase (HMGCR)Signaling Pathways >>Autophagy >>Autophagy
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

Density1.4±0.1 g/cm3
Boiling Point354.3±32.0 °C at 760 mmHg
Molecular FormulaC6H7D3O5
Molecular Weight165.159
Flash Point182.2±21.6 °C
Exact Mass165.071655
PSA94.83000
LogP-2.33
Vapour Pressure0.0±1.8 mmHg at 25°C
Index of Refraction1.515
InChIKeyNPOAOTPXWNWTSH-FIBGUPNXSA-N
SMILESCC(O)(CC(=O)O)CC(=O)O

Synonyms

3-hydroxy-3-<2H3>methylglutaric acid
3-Hydroxy-3-(H)methylpentanedioic acid
3-hydroxy-3-<methyl-2H3>pentane-1,5-dioic acid
3-Hydroxy-3-trideuteromethylglutarsaeure
3-Hydroxy-3-<3.4.5-trimethoxy-phenyl>-3-<3.4-methylendioxy-phenyl>-propionsaeure-ethylester
Pentanedioic acid, 3-hydroxy-3-(methyl-d)-
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