ChemSpider 2D Image | 1-[4-Fluoro-2-(trifluoromethyl)benzyl]-3-[2-(3-methoxypropoxy)phenyl]urea | C19H20F4N2O3

1-[4-Fluoro-2-(trifluoromethyl)benzyl]-3-[2-(3-methoxypropoxy)phenyl]urea

  • Molecular FormulaC19H20F4N2O3
  • Average mass400.367 Da
  • Monoisotopic mass400.140991 Da
  • ChemSpider ID31876159

More details:

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

1-[4-Fluor-2-(trifluormethyl)benzyl]-3-[2-(3-methoxypropoxy)phenyl]harnstoff [German] [ACD/IUPAC Name]
1-[4-Fluoro-2-(trifluoromethyl)benzyl]-3-[2-(3-methoxypropoxy)phenyl]urea [ACD/IUPAC Name]
1-[4-Fluoro-2-(trifluorométhyl)benzyl]-3-[2-(3-méthoxypropoxy)phényl]urée [French] [ACD/IUPAC Name]
Urea, N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-N'-[2-(3-methoxypropoxy)phenyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 452.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.2±3.0 kJ/mol
Flash Point: 227.4±28.7 °C
Index of Refraction: 1.532
Molar Refractivity: 95.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.28
ACD/LogD (pH 5.5): 4.02
ACD/BCF (pH 5.5): 670.01
ACD/KOC (pH 5.5): 3668.66
ACD/LogD (pH 7.4): 4.02
ACD/BCF (pH 7.4): 669.96
ACD/KOC (pH 7.4): 3668.42
Polar Surface Area: 60 Å2
Polarizability: 38.0±0.5 10-24cm3
Surface Tension: 38.5±3.0 dyne/cm
Molar Volume: 309.6±3.0 cm3

Click to predict properties on the Chemicalize site


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