ChemSpider 2D Image | 3-Furyl{4-[6-(trifluoromethyl)-4-pyrimidinyl]-1-piperazinyl}methanone | C14H13F3N4O2

3-Furyl{4-[6-(trifluoromethyl)-4-pyrimidinyl]-1-piperazinyl}methanone

  • Molecular FormulaC14H13F3N4O2
  • Average mass326.274 Da
  • Monoisotopic mass326.099060 Da
  • ChemSpider ID35300064

More details:

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

3-Furyl{4-[6-(trifluormethyl)-4-pyrimidinyl]-1-piperazinyl}methanon [German] [ACD/IUPAC Name]
3-Furyl{4-[6-(trifluoromethyl)-4-pyrimidinyl]-1-piperazinyl}methanone [ACD/IUPAC Name]
3-Furyl{4-[6-(trifluorométhyl)-4-pyrimidinyl]-1-pipérazinyl}méthanone [French] [ACD/IUPAC Name]
Methanone, 3-furanyl[4-[6-(trifluoromethyl)-4-pyrimidinyl]-1-piperazinyl]- [ACD/Index Name]
4-[4-(3-furoyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidine
4-[4-(FURAN-3-CARBONYL)PIPERAZIN-1-YL]-6-(TRIFLUOROMETHYL)PYRIMIDINE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 469.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.2±3.0 kJ/mol
Flash Point: 237.8±28.7 °C
Index of Refraction: 1.542
Molar Refractivity: 73.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.41
ACD/LogD (pH 5.5): 1.61
ACD/BCF (pH 5.5): 9.90
ACD/KOC (pH 5.5): 179.56
ACD/LogD (pH 7.4): 1.61
ACD/BCF (pH 7.4): 9.92
ACD/KOC (pH 7.4): 179.87
Polar Surface Area: 62 Å2
Polarizability: 29.0±0.5 10-24cm3
Surface Tension: 48.8±3.0 dyne/cm
Molar Volume: 232.5±3.0 cm3

Click to predict properties on the Chemicalize site


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