ChemSpider 2D Image | 1-[4-(3,4-Difluorobenzoyl)-1-piperazinyl]-2-[3-(trifluoromethyl)phenyl]ethanone | C20H17F5N2O2

1-[4-(3,4-Difluorobenzoyl)-1-piperazinyl]-2-[3-(trifluoromethyl)phenyl]ethanone

  • Molecular FormulaC20H17F5N2O2
  • Average mass412.353 Da
  • Monoisotopic mass412.121033 Da
  • ChemSpider ID30523215

More details:

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

1-[4-(3,4-Difluorbenzoyl)-1-piperazinyl]-2-[3-(trifluormethyl)phenyl]ethanon [German] [ACD/IUPAC Name]
1-[4-(3,4-Difluorobenzoyl)-1-piperazinyl]-2-[3-(trifluoromethyl)phenyl]ethanone [ACD/IUPAC Name]
1-[4-(3,4-Difluorobenzoyl)-1-pipérazinyl]-2-[3-(trifluorométhyl)phényl]éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[4-(3,4-difluorobenzoyl)-1-piperazinyl]-2-[3-(trifluoromethyl)phenyl]- [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: 540.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.8±3.0 kJ/mol
Flash Point: 280.7±30.1 °C
Index of Refraction: 1.539
Molar Refractivity: 93.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.40
ACD/LogD (pH 5.5): 2.92
ACD/BCF (pH 5.5): 98.23
ACD/KOC (pH 5.5): 928.21
ACD/LogD (pH 7.4): 2.92
ACD/BCF (pH 7.4): 98.23
ACD/KOC (pH 7.4): 928.21
Polar Surface Area: 41 Å2
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 43.3±3.0 dyne/cm
Molar Volume: 299.5±3.0 cm3

Click to predict properties on the Chemicalize site


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