ChemSpider 2D Image | 1-(1-{[1-(3-Fluorophenyl)-1H-pyrazol-4-yl]methyl}-3-pyrrolidinyl)-3,5-dimethyl-1H-pyrazole | C19H22FN5

1-(1-{[1-(3-Fluorophenyl)-1H-pyrazol-4-yl]methyl}-3-pyrrolidinyl)-3,5-dimethyl-1H-pyrazole

  • Molecular FormulaC19H22FN5
  • Average mass339.410 Da
  • Monoisotopic mass339.185913 Da
  • ChemSpider ID30925816

More details:

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

1-(1-{[1-(3-Fluorophenyl)-1H-pyrazol-4-yl]methyl}-3-pyrrolidinyl)-3,5-dimethyl-1H-pyrazole [ACD/IUPAC Name]
1-(1-{[1-(3-Fluorophényl)-1H-pyrazol-4-yl]méthyl}-3-pyrrolidinyl)-3,5-diméthyl-1H-pyrazole [French] [ACD/IUPAC Name]
1-(1-{[1-(3-Fluorphenyl)-1H-pyrazol-4-yl]methyl}-3-pyrrolidinyl)-3,5-dimethyl-1H-pyrazol [German] [ACD/IUPAC Name]
1H-Pyrazole, 1-[1-[[1-(3-fluorophenyl)-1H-pyrazol-4-yl]methyl]-3-pyrrolidinyl]-3,5-dimethyl- [ACD/Index Name]
1-(1-{[1-(3-fluorophenyl)-1H-pyrazol-4-yl]methyl}pyrrolidin-3-yl)-3,5-dimethyl-1H-pyrazole

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

Density: 1.3±0.1 g/cm3
Boiling Point: 477.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.1±3.0 kJ/mol
Flash Point: 242.4±28.7 °C
Index of Refraction: 1.649
Molar Refractivity: 97.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.73
ACD/LogD (pH 5.5): 0.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.93
ACD/LogD (pH 7.4): 1.83
ACD/BCF (pH 7.4): 9.07
ACD/KOC (pH 7.4): 96.48
Polar Surface Area: 39 Å2
Polarizability: 38.6±0.5 10-24cm3
Surface Tension: 45.9±7.0 dyne/cm
Molar Volume: 267.3±7.0 cm3

Click to predict properties on the Chemicalize site


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