ChemSpider 2D Image | 5-(3-Fluorophenyl)-4-[1-(3-furylmethyl)-4-piperidinyl]-2-(trifluoromethyl)pyrimidine | C21H19F4N3O

5-(3-Fluorophenyl)-4-[1-(3-furylmethyl)-4-piperidinyl]-2-(trifluoromethyl)pyrimidine

  • Molecular FormulaC21H19F4N3O
  • Average mass405.389 Da
  • Monoisotopic mass405.146423 Da
  • ChemSpider ID23066795

More details:

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

5-(3-Fluorophenyl)-4-[1-(3-furylmethyl)-4-piperidinyl]-2-(trifluoromethyl)pyrimidine [ACD/IUPAC Name]
5-(3-Fluorophényl)-4-[1-(3-furylméthyl)-4-pipéridinyl]-2-(trifluorométhyl)pyrimidine [French] [ACD/IUPAC Name]
5-(3-Fluorphenyl)-4-[1-(3-furylmethyl)-4-piperidinyl]-2-(trifluormethyl)pyrimidin [German] [ACD/IUPAC Name]
Pyrimidine, 5-(3-fluorophenyl)-4-[1-(3-furanylmethyl)-4-piperidinyl]-2-(trifluoromethyl)- [ACD/Index 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: 429.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.5±3.0 kJ/mol
Flash Point: 213.7±28.7 °C
Index of Refraction: 1.542
Molar Refractivity: 98.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.27
ACD/LogD (pH 5.5): 1.83
ACD/BCF (pH 5.5): 5.91
ACD/KOC (pH 5.5): 43.00
ACD/LogD (pH 7.4): 3.27
ACD/BCF (pH 7.4): 161.44
ACD/KOC (pH 7.4): 1173.78
Polar Surface Area: 42 Å2
Polarizability: 39.0±0.5 10-24cm3
Surface Tension: 43.2±3.0 dyne/cm
Molar Volume: 312.2±3.0 cm3

Click to predict properties on the Chemicalize site


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