Monoisobutyl phthalic acid-d4

Modify Date: 2024-01-02 18:30:08

Monoisobutyl phthalic acid-d4 Structure
Monoisobutyl phthalic acid-d4 structure
Common Name Monoisobutyl phthalic acid-d4
CAS Number 1219802-26-2 Molecular Weight 226.26200
Density N/A Boiling Point N/A
Molecular Formula C12H10D4O4 Melting Point N/A
MSDS N/A Flash Point N/A

 Use of Monoisobutyl phthalic acid-d4


Monoisobutyl phthalic acid-d4 is the deuterium labeled Monoisobutyl phthalic acid[1]. Monoisobutyl phthalic acid is a phthalate metabolite that is in human semen and in meconium[2].

 Names

Name Monoisobutyl Phthalate-d4
Synonym More Synonyms

 Monoisobutyl phthalic acid-d4 Biological Activity

Description Monoisobutyl phthalic acid-d4 is the deuterium labeled Monoisobutyl phthalic acid[1]. Monoisobutyl phthalic acid is a phthalate metabolite that is in human semen and in meconium[2].
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]. Kato K, et al. Quantifying phthalate metabolites in human meconium and semen using automated off-line solid-phase extraction coupled with on-line SPE and isotope-dilution high-performance liquid chromatography--tandem mass spectrometry. Anal Chem. 2006 Sep 15;78(18):6651-5.  

 Chemical & Physical Properties

Molecular Formula C12H10D4O4
Molecular Weight 226.26200
Exact Mass 226.11400
PSA 63.60000
LogP 2.19760

 Synonyms

2,3,4,5-tetradeuterio-6-(2-methylpropoxycarbonyl)benzoic acid