1219803-48-1

1219803-48-1 structure
1219803-48-1 structure
  • Name: Chlorotoluron-d6
  • Chemical Name: Chlorotoluron-d6
  • CAS Number: 1219803-48-1
  • Molecular Formula: C10H7ClD6N2O
  • Molecular Weight: 218.713
  • Catalog: Research Areas Others
  • Create Date: 2018-08-09 23:03:31
  • Modify Date: 2024-01-08 21:23:57
  • 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].

Name Chlorotoluron-d6
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
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.  

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