ChemSpider 2D Image | (2E)-3-(4-Methylphenyl)-3-[3-(4-methylphenyl)-1H-pyrazol-1-yl]acrylaldehyde | C20H18N2O

(2E)-3-(4-Methylphenyl)-3-[3-(4-methylphenyl)-1H-pyrazol-1-yl]acrylaldehyde

  • Molecular FormulaC20H18N2O
  • Average mass302.370 Da
  • Monoisotopic mass302.141907 Da
  • ChemSpider ID24741034

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-(4-Methylphenyl)-3-[3-(4-methylphenyl)-1H-pyrazol-1-yl]acrylaldehyd [German] [ACD/IUPAC Name]
(2E)-3-(4-Methylphenyl)-3-[3-(4-methylphenyl)-1H-pyrazol-1-yl]acrylaldehyde [ACD/IUPAC Name]
(2E)-3-(4-Méthylphényl)-3-[3-(4-méthylphényl)-1H-pyrazol-1-yl]acrylaldéhyde [French] [ACD/IUPAC Name]
2-Propenal, 3-(4-methylphenyl)-3-[3-(4-methylphenyl)-1H-pyrazol-1-yl]-, (2E)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 428.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.3±3.0 kJ/mol
Flash Point: 212.9±28.7 °C
Index of Refraction: 1.590
Molar Refractivity: 94.6±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.23
ACD/LogD (pH 5.5): 4.44
ACD/BCF (pH 5.5): 1392.55
ACD/KOC (pH 5.5): 6193.08
ACD/LogD (pH 7.4): 4.44
ACD/BCF (pH 7.4): 1392.89
ACD/KOC (pH 7.4): 6194.59
Polar Surface Area: 35 Å2
Polarizability: 37.5±0.5 10-24cm3
Surface Tension: 40.6±7.0 dyne/cm
Molar Volume: 280.0±7.0 cm3

Click to predict properties on the Chemicalize site


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