ChemSpider 2D Image | 5-Fluoro-2-[4-(1H-pyrazol-5-yl)phenyl]-4-(1-pyrrolidinyl)pyrimidine | C17H16FN5

5-Fluoro-2-[4-(1H-pyrazol-5-yl)phenyl]-4-(1-pyrrolidinyl)pyrimidine

  • Molecular FormulaC17H16FN5
  • Average mass309.341 Da
  • Monoisotopic mass309.138977 Da
  • ChemSpider ID57634489

More details:

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

5-Fluor-2-[4-(1H-pyrazol-5-yl)phenyl]-4-(1-pyrrolidinyl)pyrimidin [German] [ACD/IUPAC Name]
5-Fluoro-2-[4-(1H-pyrazol-5-yl)phenyl]-4-(1-pyrrolidinyl)pyrimidine [ACD/IUPAC Name]
5-Fluoro-2-[4-(1H-pyrazol-5-yl)phényl]-4-(1-pyrrolidinyl)pyrimidine [French] [ACD/IUPAC Name]
Pyrimidine, 5-fluoro-2-[4-(1H-pyrazol-5-yl)phenyl]-4-(1-pyrrolidinyl)- [ACD/Index Name]
5-FLUORO-2-[4-(1H-PYRAZOL-5-YL)PHENYL]-4-(PYRROLIDIN-1-YL)PYRIMIDINE
5-fluoro-2-[4-(1H-pyrazol-5-yl)phenyl]-4-pyrrolidin-1-ylpyrimidine
5-FLUORO-2-[4-(2H-PYRAZOL-3-YL)PHENYL]-4-(PYRROLIDIN-1-YL)PYRIMIDINE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 444.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.2±3.0 kJ/mol
Flash Point: 222.6±28.7 °C
Index of Refraction: 1.631
Molar Refractivity: 84.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.77
ACD/LogD (pH 5.5): 2.86
ACD/BCF (pH 5.5): 79.74
ACD/KOC (pH 5.5): 717.86
ACD/LogD (pH 7.4): 3.02
ACD/BCF (pH 7.4): 115.82
ACD/KOC (pH 7.4): 1042.66
Polar Surface Area: 58 Å2
Polarizability: 33.4±0.5 10-24cm3
Surface Tension: 60.5±3.0 dyne/cm
Molar Volume: 236.7±3.0 cm3

Click to predict properties on the Chemicalize site


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