ChemSpider 2D Image | 1,1-Bis(4-fluorophenyl)-3-{4-[(2E)-3-phenyl-2-propen-1-yl]-1-piperazinyl}-1-propanol | C28H30F2N2O

1,1-Bis(4-fluorophenyl)-3-{4-[(2E)-3-phenyl-2-propen-1-yl]-1-piperazinyl}-1-propanol

  • Molecular FormulaC28H30F2N2O
  • Average mass448.547 Da
  • Monoisotopic mass448.232605 Da
  • ChemSpider ID31019837
  • Double-bond stereo - Double-bond stereo


More details:






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

1,1-Bis(4-fluorophenyl)-3-{4-[(2E)-3-phenyl-2-propen-1-yl]-1-piperazinyl}-1-propanol [ACD/IUPAC Name]
1,1-Bis(4-fluorophényl)-3-{4-[(2E)-3-phényl-2-propén-1-yl]-1-pipérazinyl}-1-propanol [French] [ACD/IUPAC Name]
1,1-Bis(4-fluorphenyl)-3-{4-[(2E)-3-phenyl-2-propen-1-yl]-1-piperazinyl}-1-propanol [German] [ACD/IUPAC Name]
1-Piperazinepropanol, α,α-bis(4-fluorophenyl)-4-[(2E)-3-phenyl-2-propen-1-yl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 592.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.9±3.0 kJ/mol
Flash Point: 311.9±30.1 °C
Index of Refraction: 1.599
Molar Refractivity: 129.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.24
ACD/LogD (pH 5.5): 2.47
ACD/BCF (pH 5.5): 13.87
ACD/KOC (pH 5.5): 58.13
ACD/LogD (pH 7.4): 4.13
ACD/BCF (pH 7.4): 637.60
ACD/KOC (pH 7.4): 2671.74
Polar Surface Area: 27 Å2
Polarizability: 51.4±0.5 10-24cm3
Surface Tension: 46.4±3.0 dyne/cm
Molar Volume: 379.7±3.0 cm3

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