Chlorotoluron-d6

Modify Date: 2024-01-08 21:23:57

Chlorotoluron-d6 Structure
Chlorotoluron-d6 structure
Common Name Chlorotoluron-d6
CAS Number 1219803-48-1 Molecular Weight 218.713
Density 1.2±0.1 g/cm3 Boiling Point 367.8±42.0 °C at 760 mmHg
Molecular Formula C10H7ClD6N2O Melting Point N/A
MSDS Chinese USA Flash Point 176.2±27.9 °C

 Use of Chlorotoluron-d6


Chlorotoluron-d6 is the deuterium labeled Chlorotoluron[1]. Chlorotoluron (Chlortoluron) is a substituted phenylurea herbicide, is widely used for selective weed control in cereals crops and is an environmental pollutant[2].

 Names

Name Chlorotoluron-d6
Synonym More Synonyms

 Chlorotoluron-d6 Biological Activity

Description Chlorotoluron-d6 is the deuterium labeled Chlorotoluron[1]. Chlorotoluron (Chlortoluron) is a substituted phenylurea herbicide, is widely used for selective weed control in cereals crops and is an environmental pollutant[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]. Z Mehmood, et al. Metabolism of the Herbicide Chlortoluron by Human Cytochrome P450 3A4. Chemosphere. 1995 Dec;31(11-12):4515-29.  

 Chemical & Physical Properties

Density 1.2±0.1 g/cm3
Boiling Point 367.8±42.0 °C at 760 mmHg
Molecular Formula C10H7ClD6N2O
Molecular Weight 218.713
Flash Point 176.2±27.9 °C
Exact Mass 218.109299
PSA 35.83000
LogP 2.46
Vapour Pressure 0.0±0.8 mmHg at 25°C
Index of Refraction 1.586

 Synonyms

Urea, N'-(3-chloro-4-methylphenyl)-N,N-dimethyl-d-
3-(3-chloro-4-methylphenyl)-1,1-bis(trideuteriomethyl)urea
3-(3-Chloro-4-methylphenyl)-1,1-bis[(H)methyl]urea