ChemSpider 2D Image | 1-Cycloheptyl-3-{[4-(4-fluorophenyl)tetrahydro-2H-pyran-4-yl]methyl}urea | C20H29FN2O2

1-Cycloheptyl-3-{[4-(4-fluorophenyl)tetrahydro-2H-pyran-4-yl]methyl}urea

  • Molecular FormulaC20H29FN2O2
  • Average mass348.455 Da
  • Monoisotopic mass348.221313 Da
  • ChemSpider ID30072240

More details:

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

1-Cycloheptyl-3-{[4-(4-fluorophenyl)tetrahydro-2H-pyran-4-yl]methyl}urea [ACD/IUPAC Name]
1-Cycloheptyl-3-{[4-(4-fluorophényl)tétrahydro-2H-pyran-4-yl]méthyl}urée [French] [ACD/IUPAC Name]
1-Cycloheptyl-3-{[4-(4-fluorphenyl)tetrahydro-2H-pyran-4-yl]methyl}harnstoff [German] [ACD/IUPAC Name]
Urea, N-cycloheptyl-N'-[[4-(4-fluorophenyl)tetrahydro-2H-pyran-4-yl]methyl]- [ACD/Index Name]
1396750-31-4 [RN]
1-cycloheptyl-3-((4-(4-fluorophenyl)tetrahydro-2H-pyran-4-yl)methyl)urea
1-cycloheptyl-3-{[4-(4-fluorophenyl)oxan-4-yl]methyl}urea

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

Density: 1.1±0.1 g/cm3
Boiling Point: 528.8±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.4±3.0 kJ/mol
Flash Point: 273.6±26.8 °C
Index of Refraction: 1.546
Molar Refractivity: 96.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.84
ACD/LogD (pH 5.5): 3.88
ACD/BCF (pH 5.5): 528.27
ACD/KOC (pH 5.5): 3094.72
ACD/LogD (pH 7.4): 3.88
ACD/BCF (pH 7.4): 528.26
ACD/KOC (pH 7.4): 3094.71
Polar Surface Area: 50 Å2
Polarizability: 38.4±0.5 10-24cm3
Surface Tension: 44.5±5.0 dyne/cm
Molar Volume: 305.5±5.0 cm3

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