ChemSpider 2D Image | 3-(3-Chloro-2-hydroxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde | C16H11ClN2O2

3-(3-Chloro-2-hydroxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde

  • Molecular FormulaC16H11ClN2O2
  • Average mass298.724 Da
  • Monoisotopic mass298.050903 Da
  • ChemSpider ID30657027

More details:

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

1H-Pyrazole-4-carboxaldehyde, 3-(3-chloro-2-hydroxyphenyl)-1-phenyl- [ACD/Index Name]
3-(3-Chlor-2-hydroxyphenyl)-1-phenyl-1H-pyrazol-4-carbaldehyd [German] [ACD/IUPAC Name]
3-(3-Chloro-2-hydroxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde [ACD/IUPAC Name]
3-(3-Chloro-2-hydroxyphényl)-1-phényl-1H-pyrazole-4-carbaldéhyde [French] [ACD/IUPAC 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: 479.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.2±3.0 kJ/mol
Flash Point: 243.6±28.7 °C
Index of Refraction: 1.652
Molar Refractivity: 82.0±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.31
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 274.85
ACD/KOC (pH 5.5): 1917.36
ACD/LogD (pH 7.4): 2.92
ACD/BCF (pH 7.4): 68.95
ACD/KOC (pH 7.4): 481.02
Polar Surface Area: 55 Å2
Polarizability: 32.5±0.5 10-24cm3
Surface Tension: 52.1±7.0 dyne/cm
Molar Volume: 224.0±7.0 cm3

Click to predict properties on the Chemicalize site


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