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Thymol-d13

Names

[ CAS No. ]:
1219798-93-2

[ Name ]:
Thymol-d13

[Synonym ]:
5-(2H3)Methyl-2-[(2H7)propan-2-yl](2H3)phenol
5-(2H3)Methyl-2-[(2H7)-2-propanyl](2H3)phenol
Phenol-2,4,5-d3, 3-(methyl-d3)-6-[1-(methyl-d3)ethyl-1,2,2,2-d4]-

Biological Activity

[Description]:

Thymol-d13 is the deuterium labeled Thymol[1]. Thymol is the main monoterpene phenol occurring in essential oils isolated from plants belonging to the Lamiaceae family, and other plants such as those belonging to the Verbenaceae, Scrophulariaceae, Ranunculaceae and Apiaceae families. Thymol has antioxidant, anti-inflammatory, antibacterial and antifungal effects[2].

[Related Catalog]:

Signaling Pathways >> Anti-infection >> Bacterial

[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]. Marchese A, et al. Antibacterial and antifungal activities of thymol: A brief review of the literature. Food Chem. 2016 Nov 1;210:402-14.  

Chemical & Physical Properties

[ Density]:
1.0±0.1 g/cm3

[ Boiling Point ]:
233.0±0.0 °C at 760 mmHg

[ Molecular Formula ]:
C10HD13O

[ Molecular Weight ]:
163.298

[ Flash Point ]:
102.2±0.0 °C

[ Exact Mass ]:
163.186066

[ LogP ]:
3.28

[ Vapour Pressure ]:
0.0±0.4 mmHg at 25°C

[ Index of Refraction ]:
1.523

Related Compounds