ChemSpider 2D Image | 1-(2,2-Difluoroethyl)-1-propyl-3-(3,4,5-trimethoxybenzyl)urea | C16H24F2N2O4

1-(2,2-Difluoroethyl)-1-propyl-3-(3,4,5-trimethoxybenzyl)urea

  • Molecular FormulaC16H24F2N2O4
  • Average mass346.370 Da
  • Monoisotopic mass346.170410 Da
  • ChemSpider ID30737312

More details:






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

1-(2,2-Difluorethyl)-1-propyl-3-(3,4,5-trimethoxybenzyl)harnstoff [German] [ACD/IUPAC Name]
1-(2,2-Difluoroethyl)-1-propyl-3-(3,4,5-trimethoxybenzyl)urea [ACD/IUPAC Name]
1-(2,2-Difluoroéthyl)-1-propyl-3-(3,4,5-triméthoxybenzyl)urée [French] [ACD/IUPAC Name]
Urea, N-(2,2-difluoroethyl)-N-propyl-N'-[(3,4,5-trimethoxyphenyl)methyl]- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 492.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.0±3.0 kJ/mol
Flash Point: 251.7±28.7 °C
Index of Refraction: 1.487
Molar Refractivity: 86.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.29
ACD/LogD (pH 5.5): 2.38
ACD/BCF (pH 5.5): 38.02
ACD/KOC (pH 5.5): 470.57
ACD/LogD (pH 7.4): 2.38
ACD/BCF (pH 7.4): 38.02
ACD/KOC (pH 7.4): 470.56
Polar Surface Area: 60 Å2
Polarizability: 34.3±0.5 10-24cm3
Surface Tension: 34.1±3.0 dyne/cm
Molar Volume: 301.3±3.0 cm3

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