CAS 1007536-67-5|3-(3,4-Dichlorophenyl)-1,1-bis[(2H3)methyl]urea
Introduction:Basic information about CAS 1007536-67-5|3-(3,4-Dichlorophenyl)-1,1-bis[(2H3)methyl]urea, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Research Areas >>OthersSignaling 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[75].
References
[1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53(2):211-223.
Chemical & Physical Properties
Density
1.4±0.1 g/cm3
Boiling Point
385.2±42.0 °C at 760 mmHg
Melting Point
147-150?C
Molecular Formula
C9H4D6Cl2N2O
Molecular Weight
239.13
Flash Point
186.7±27.9 °C
Exact Mass
238.054672
PSA
35.83000
LogP
2.78
Vapour Pressure
0.0±0.9 mmHg at 25°C
Index of Refraction
1.606
InChIKey
XMTQQYYKAHVGBJ-WFGJKAKNSA-N
SMILES
CN(C)C(=O)Nc1ccc(Cl)c(Cl)c1
Storage condition
Refrigerator
Safety Information
Symbol
GHS07, GHS08, GHS09
Signal Word
Warning
Hazard Statements
H302-H351-H373-H410
Precautionary Statements
P260-P280-P301 + P312 + P330
Personal Protective Equipment
dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes
Xn,N
Risk Phrases
22-40-48/22-50/53
Safety Phrases
13-22-23-37-46-60-61-36/37
RIDADR
UN 3077 9/PG 3
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