ChemSpider 2D Image | 5-Benzoyl-1-butyl-4-phenyl-2(1H)-pyrimidinone | C21H20N2O2

5-Benzoyl-1-butyl-4-phenyl-2(1H)-pyrimidinone

  • Molecular FormulaC21H20N2O2
  • Average mass332.396 Da
  • Monoisotopic mass332.152466 Da
  • ChemSpider ID21131230

More details:

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

2(1H)-Pyrimidinone, 5-benzoyl-1-butyl-4-phenyl- [ACD/Index Name]
5-Benzoyl-1-butyl-4-phenyl-2(1H)-pyrimidinon [German] [ACD/IUPAC Name]
5-Benzoyl-1-butyl-4-phenyl-2(1H)-pyrimidinone [ACD/IUPAC Name]
5-Benzoyl-1-butyl-4-phényl-2(1H)-pyrimidinone [French] [ACD/IUPAC Name]
127143-67-3 [RN]
5-Benzoyl-1-butyl-4-phenylpyrimidin-2(1H)-one

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

Density: 1.1±0.1 g/cm3
Boiling Point: 472.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.5±3.0 kJ/mol
Flash Point: 239.3±31.5 °C
Index of Refraction: 1.597
Molar Refractivity: 100.2±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.72
ACD/LogD (pH 5.5): 3.11
ACD/BCF (pH 5.5): 136.73
ACD/KOC (pH 5.5): 1176.13
ACD/LogD (pH 7.4): 3.11
ACD/BCF (pH 7.4): 136.73
ACD/KOC (pH 7.4): 1176.13
Polar Surface Area: 50 Å2
Polarizability: 39.7±0.5 10-24cm3
Surface Tension: 44.2±7.0 dyne/cm
Molar Volume: 294.2±7.0 cm3

Click to predict properties on the Chemicalize site


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