Methyl 3,4,5-trimethoxybenzoate-d9

Names

[ CAS No. ]:
1182838-07-8

[ Name ]:
Methyl 3,4,5-trimethoxybenzoate-d9

[Synonym ]:
Benzoic acid, 3,4,5-tris(methyl-d3-oxy)-, methyl ester
Methyl 3,4,5-tris[(2H3)methyloxy]benzoate

Biological Activity

[Description]:

Methyl 3,4,5-trimethoxybenzoate-d9 is the deuterium labeled Methyl 3,4,5-trimethoxybenzoate[1]. Methyl 3,4,5-trimethoxybenzoate can be synthesized from Gallic acid. Methyl 3,4,5-trimethoxybenzoate is mainly used in the production of Trimethoprim (TMP), Sulfa synergistic intermediates, and many other agents[2].

[Related Catalog]:

Research Areas >> Others
Signaling Pathways >> Others >> Others

[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]. Method for synthesizing methyl 3,4,5-trimethoxybenzoate from gallic acid. CN105732375A.

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
274.5±0.0 °C at 760 mmHg

[ Molecular Formula ]:
C11H5D9O5

[ Molecular Weight ]:
235.281

[ Flash Point ]:
115.2±18.2 °C

[ Exact Mass ]:
235.140610

[ LogP ]:
1.74

[ Vapour Pressure ]:
0.0±0.5 mmHg at 25°C

[ Index of Refraction ]:
1.494

Related Compounds