ChemSpider 2D Image | 1-(4-Chloro-3-nitrophenyl)-3-{2-hydroxy-3-[3-(trifluoromethyl)phenoxy]propyl}urea | C17H15ClF3N3O5

1-(4-Chloro-3-nitrophenyl)-3-{2-hydroxy-3-[3-(trifluoromethyl)phenoxy]propyl}urea

  • Molecular FormulaC17H15ClF3N3O5
  • Average mass433.766 Da
  • Monoisotopic mass433.065247 Da
  • ChemSpider ID31906235

More details:

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

1-(4-Chlor-3-nitrophenyl)-3-{2-hydroxy-3-[3-(trifluormethyl)phenoxy]propyl}harnstoff [German] [ACD/IUPAC Name]
1-(4-Chloro-3-nitrophenyl)-3-{2-hydroxy-3-[3-(trifluoromethyl)phenoxy]propyl}urea [ACD/IUPAC Name]
1-(4-Chloro-3-nitrophényl)-3-{2-hydroxy-3-[3-(trifluorométhyl)phénoxy]propyl}urée [French] [ACD/IUPAC Name]
Urea, N-(4-chloro-3-nitrophenyl)-N'-[2-hydroxy-3-[3-(trifluoromethyl)phenoxy]propyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 552.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.7±3.0 kJ/mol
Flash Point: 288.1±30.1 °C
Index of Refraction: 1.593
Molar Refractivity: 97.5±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.86
ACD/LogD (pH 5.5): 4.09
ACD/BCF (pH 5.5): 759.86
ACD/KOC (pH 5.5): 4014.47
ACD/LogD (pH 7.4): 4.09
ACD/BCF (pH 7.4): 759.58
ACD/KOC (pH 7.4): 4013.03
Polar Surface Area: 116 Å2
Polarizability: 38.7±0.5 10-24cm3
Surface Tension: 52.0±3.0 dyne/cm
Molar Volume: 287.9±3.0 cm3

Click to predict properties on the Chemicalize site


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