ChemSpider 2D Image | 4-(4-Ethylphenyl)-5-iodo-3-(2-methyl-2-propanyl)-1-phenyl-1H-pyrazole | C21H23IN2

4-(4-Ethylphenyl)-5-iodo-3-(2-methyl-2-propanyl)-1-phenyl-1H-pyrazole

  • Molecular FormulaC21H23IN2
  • Average mass430.325 Da
  • Monoisotopic mass430.090576 Da
  • ChemSpider ID122747685

More details:

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

1H-Pyrazole, 3-(1,1-dimethylethyl)-4-(4-ethylphenyl)-5-iodo-1-phenyl- [ACD/Index Name]
4-(4-Ethylphenyl)-5-iod-3-(2-methyl-2-propanyl)-1-phenyl-1H-pyrazol [German] [ACD/IUPAC Name]
4-(4-Ethylphenyl)-5-iodo-3-(2-methyl-2-propanyl)-1-phenyl-1H-pyrazole [ACD/IUPAC Name]
4-(4-Éthylphényl)-5-iodo-3-(2-méthyl-2-propanyl)-1-phényl-1H-pyrazole [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: 491.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.0±3.0 kJ/mol
Flash Point: 251.2±28.7 °C
Index of Refraction: 1.611
Molar Refractivity: 111.1±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 7.97
ACD/LogD (pH 5.5): 6.92
ACD/BCF (pH 5.5): 107535.73
ACD/KOC (pH 5.5): 139047.81
ACD/LogD (pH 7.4): 6.92
ACD/BCF (pH 7.4): 107535.73
ACD/KOC (pH 7.4): 139047.81
Polar Surface Area: 18 Å2
Polarizability: 44.1±0.5 10-24cm3
Surface Tension: 39.5±7.0 dyne/cm
Molar Volume: 320.1±7.0 cm3

Click to predict properties on the Chemicalize site


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