ChemSpider 2D Image | 1-[4-Chloro-3-(trifluoromethyl)phenyl]-3-(3,4-dimethylphenyl)urea | C16H14ClF3N2O

1-[4-Chloro-3-(trifluoromethyl)phenyl]-3-(3,4-dimethylphenyl)urea

  • Molecular FormulaC16H14ClF3N2O
  • Average mass342.743 Da
  • Monoisotopic mass342.074677 Da
  • ChemSpider ID26005307

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1-[4-Chlor-3-(trifluormethyl)phenyl]-3-(3,4-dimethylphenyl)harnstoff [German] [ACD/IUPAC Name]
1-[4-Chloro-3-(trifluoromethyl)phenyl]-3-(3,4-dimethylphenyl)urea [ACD/IUPAC Name]
1-[4-Chloro-3-(trifluorométhyl)phényl]-3-(3,4-diméthylphényl)urée [French] [ACD/IUPAC Name]
Urea, N-[4-chloro-3-(trifluoromethyl)phenyl]-N'-(3,4-dimethylphenyl)- [ACD/Index Name]
1-(4-Chloro-3-trifluoromethyl-phenyl)-3-(3,4-dimethyl-phenyl)-urea
MFCD06142314 [MDL number]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 338.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.1±3.0 kJ/mol
Flash Point: 158.3±27.9 °C
Index of Refraction: 1.598
Molar Refractivity: 84.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.26
ACD/LogD (pH 5.5): 5.44
ACD/BCF (pH 5.5): 8019.48
ACD/KOC (pH 5.5): 21685.92
ACD/LogD (pH 7.4): 5.44
ACD/BCF (pH 7.4): 8018.73
ACD/KOC (pH 7.4): 21683.89
Polar Surface Area: 41 Å2
Polarizability: 33.5±0.5 10-24cm3
Surface Tension: 42.8±3.0 dyne/cm
Molar Volume: 247.9±3.0 cm3

Click to predict properties on the Chemicalize site


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