ChemSpider 2D Image | MFCD12196010 | C16H10FN3

MFCD12196010

  • Molecular FormulaC16H10FN3
  • Average mass263.269 Da
  • Monoisotopic mass263.085876 Da
  • ChemSpider ID38242686

More details:

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

1-(2-Fluorophenyl)-3-phenyl-1H-pyrazole-4-carbonitrile [ACD/IUPAC Name]
1-(2-Fluorophényl)-3-phényl-1H-pyrazole-4-carbonitrile [French] [ACD/IUPAC Name]
1-(2-Fluorphenyl)-3-phenyl-1H-pyrazol-4-carbonitril [German] [ACD/IUPAC Name]
1H-Pyrazole-4-carbonitrile, 1-(2-fluorophenyl)-3-phenyl- [ACD/Index Name]
MFCD12196010
1-(2-FLUOROPHENYL)-3-PHENYLPYRAZOLE-4-CARBONITRILE
908140-36-3 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 456.3±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.6±3.0 kJ/mol
Flash Point: 229.8±27.3 °C
Index of Refraction: 1.622
Molar Refractivity: 77.4±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.42
ACD/LogD (pH 5.5): 3.76
ACD/BCF (pH 5.5): 422.58
ACD/KOC (pH 5.5): 2637.71
ACD/LogD (pH 7.4): 3.76
ACD/BCF (pH 7.4): 422.58
ACD/KOC (pH 7.4): 2637.71
Polar Surface Area: 42 Å2
Polarizability: 30.7±0.5 10-24cm3
Surface Tension: 44.9±7.0 dyne/cm
Molar Volume: 219.8±7.0 cm3

Click to predict properties on the Chemicalize site


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