ChemSpider 2D Image | 4-[4-(2,3-Dimethylphenyl)-1-piperazinyl]-3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide | C26H25F3N4O3

4-[4-(2,3-Dimethylphenyl)-1-piperazinyl]-3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide

  • Molecular FormulaC26H25F3N4O3
  • Average mass498.497 Da
  • Monoisotopic mass498.187866 Da
  • ChemSpider ID22475236

More details:

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

4-[4-(2,3-Dimethylphenyl)-1-piperazinyl]-3-nitro-N-[4-(trifluormethyl)phenyl]benzamid [German] [ACD/IUPAC Name]
4-[4-(2,3-Dimethylphenyl)-1-piperazinyl]-3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide [ACD/IUPAC Name]
4-[4-(2,3-Diméthylphényl)-1-pipérazinyl]-3-nitro-N-[4-(trifluorométhyl)phényl]benzamide [French] [ACD/IUPAC Name]
Benzamide, 4-[4-(2,3-dimethylphenyl)-1-piperazinyl]-3-nitro-N-[4-(trifluoromethyl)phenyl]- [ACD/Index Name]
4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-nitro-N-[4-(trifluoromethyl)phenyl]benzamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 592.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.4±3.0 kJ/mol
Flash Point: 312.1±30.1 °C
Index of Refraction: 1.614
Molar Refractivity: 130.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 6.79
ACD/LogD (pH 5.5): 4.91
ACD/BCF (pH 5.5): 2188.17
ACD/KOC (pH 5.5): 5527.16
ACD/LogD (pH 7.4): 5.56
ACD/BCF (pH 7.4): 9739.51
ACD/KOC (pH 7.4): 24601.34
Polar Surface Area: 81 Å2
Polarizability: 51.6±0.5 10-24cm3
Surface Tension: 51.7±3.0 dyne/cm
Molar Volume: 373.7±3.0 cm3

Click to predict properties on the Chemicalize site


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