ChemSpider 2D Image | [1-(2,4-Dichlorophenyl)-1H-pyrazol-4-yl][4-(2,4-difluorophenoxy)-1-piperidinyl]methanone | C21H17Cl2F2N3O2

[1-(2,4-Dichlorophenyl)-1H-pyrazol-4-yl][4-(2,4-difluorophenoxy)-1-piperidinyl]methanone

  • Molecular FormulaC21H17Cl2F2N3O2
  • Average mass452.281 Da
  • Monoisotopic mass451.066589 Da
  • ChemSpider ID48128423

More details:

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

[1-(2,4-Dichlorophenyl)-1H-pyrazol-4-yl][4-(2,4-difluorophenoxy)-1-piperidinyl]methanone [ACD/IUPAC Name]
[1-(2,4-Dichlorophényl)-1H-pyrazol-4-yl][4-(2,4-difluorophénoxy)-1-pipéridinyl]méthanone [French] [ACD/IUPAC Name]
[1-(2,4-Dichlorphenyl)-1H-pyrazol-4-yl][4-(2,4-difluorphenoxy)-1-piperidinyl]methanon [German] [ACD/IUPAC Name]
Methanone, [1-(2,4-dichlorophenyl)-1H-pyrazol-4-yl][4-(2,4-difluorophenoxy)-1-piperidinyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 588.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 87.9±3.0 kJ/mol
Flash Point: 310.0±30.1 °C
Index of Refraction: 1.635
Molar Refractivity: 111.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.66
ACD/LogD (pH 5.5): 5.35
ACD/BCF (pH 5.5): 6852.77
ACD/KOC (pH 5.5): 19377.80
ACD/LogD (pH 7.4): 5.35
ACD/BCF (pH 7.4): 6852.77
ACD/KOC (pH 7.4): 19377.80
Polar Surface Area: 47 Å2
Polarizability: 44.1±0.5 10-24cm3
Surface Tension: 47.7±7.0 dyne/cm
Molar Volume: 310.9±7.0 cm3

Click to predict properties on the Chemicalize site


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