ChemSpider 2D Image | [1-(Difluoromethyl)-1H-pyrazol-5-yl]{4-[3-(2,3-dimethylphenoxy)propyl]-1-piperazinyl}methanone | C20H26F2N4O2

[1-(Difluoromethyl)-1H-pyrazol-5-yl]{4-[3-(2,3-dimethylphenoxy)propyl]-1-piperazinyl}methanone

  • Molecular FormulaC20H26F2N4O2
  • Average mass392.443 Da
  • Monoisotopic mass392.202393 Da
  • ChemSpider ID24987412

More details:

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

[1-(Difluormethyl)-1H-pyrazol-5-yl]{4-[3-(2,3-dimethylphenoxy)propyl]-1-piperazinyl}methanon [German] [ACD/IUPAC Name]
[1-(Difluoromethyl)-1H-pyrazol-5-yl]{4-[3-(2,3-dimethylphenoxy)propyl]-1-piperazinyl}methanone [ACD/IUPAC Name]
[1-(Difluorométhyl)-1H-pyrazol-5-yl]{4-[3-(2,3-diméthylphénoxy)propyl]-1-pipérazinyl}méthanone [French] [ACD/IUPAC Name]
Methanone, [1-(difluoromethyl)-1H-pyrazol-5-yl][4-[3-(2,3-dimethylphenoxy)propyl]-1-piperazinyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 538.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.5±3.0 kJ/mol
Flash Point: 279.2±30.1 °C
Index of Refraction: 1.574
Molar Refractivity: 103.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.77
ACD/LogD (pH 5.5): 1.21
ACD/BCF (pH 5.5): 2.44
ACD/KOC (pH 5.5): 29.03
ACD/LogD (pH 7.4): 2.37
ACD/BCF (pH 7.4): 35.78
ACD/KOC (pH 7.4): 426.23
Polar Surface Area: 51 Å2
Polarizability: 41.1±0.5 10-24cm3
Surface Tension: 41.1±7.0 dyne/cm
Molar Volume: 313.8±7.0 cm3

Click to predict properties on the Chemicalize site


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