ChemSpider 2D Image | 1-{[1-(2,4-Difluorophenyl)-1H-pyrazol-4-yl]methyl}-3-{2-[(2-nitrophenyl)amino]ethyl}urea | C19H18F2N6O3

1-{[1-(2,4-Difluorophenyl)-1H-pyrazol-4-yl]methyl}-3-{2-[(2-nitrophenyl)amino]ethyl}urea

  • Molecular FormulaC19H18F2N6O3
  • Average mass416.381 Da
  • Monoisotopic mass416.140839 Da
  • ChemSpider ID34364251

More details:

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

1-{[1-(2,4-Difluorophenyl)-1H-pyrazol-4-yl]methyl}-3-{2-[(2-nitrophenyl)amino]ethyl}urea [ACD/IUPAC Name]
1-{[1-(2,4-Difluorophényl)-1H-pyrazol-4-yl]méthyl}-3-{2-[(2-nitrophényl)amino]éthyl}urée [French] [ACD/IUPAC Name]
1-{[1-(2,4-Difluorphenyl)-1H-pyrazol-4-yl]methyl}-3-{2-[(2-nitrophenyl)amino]ethyl}harnstoff [German] [ACD/IUPAC Name]
Urea, N-[[1-(2,4-difluorophenyl)-1H-pyrazol-4-yl]methyl]-N'-[2-[(2-nitrophenyl)amino]ethyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 676.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.3±3.0 kJ/mol
Flash Point: 362.9±31.5 °C
Index of Refraction: 1.641
Molar Refractivity: 104.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.11
ACD/LogD (pH 5.5): 3.03
ACD/BCF (pH 5.5): 118.89
ACD/KOC (pH 5.5): 1064.14
ACD/LogD (pH 7.4): 3.03
ACD/BCF (pH 7.4): 118.89
ACD/KOC (pH 7.4): 1064.13
Polar Surface Area: 117 Å2
Polarizability: 41.6±0.5 10-24cm3
Surface Tension: 54.0±7.0 dyne/cm
Molar Volume: 290.8±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement