ChemSpider 2D Image | 3-Butyl-2-(4-methylphenoxy)[1]benzofuro[3,2-d]pyrimidin-4(3H)-one | C21H20N2O3

3-Butyl-2-(4-methylphenoxy)[1]benzofuro[3,2-d]pyrimidin-4(3H)-one

  • Molecular FormulaC21H20N2O3
  • Average mass348.395 Da
  • Monoisotopic mass348.147400 Da
  • ChemSpider ID21126167

More details:

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

3-Butyl-2-(4-methylphenoxy)[1]benzofuro[3,2-d]pyrimidin-4(3H)-on [German] [ACD/IUPAC Name]
3-Butyl-2-(4-methylphenoxy)[1]benzofuro[3,2-d]pyrimidin-4(3H)-one [ACD/IUPAC Name]
3-Butyl-2-(4-méthylphénoxy)[1]benzofuro[3,2-d]pyrimidin-4(3H)-one [French] [ACD/IUPAC Name]
Benzofuro[3,2-d]pyrimidin-4(3H)-one, 3-butyl-2-(4-methylphenoxy)- [ACD/Index Name]
929208-93-5 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 496.5±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.4±3.0 kJ/mol
Flash Point: 254.0±29.3 °C
Index of Refraction: 1.627
Molar Refractivity: 99.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.19
ACD/LogD (pH 5.5): 4.42
ACD/BCF (pH 5.5): 1354.84
ACD/KOC (pH 5.5): 6073.00
ACD/LogD (pH 7.4): 4.42
ACD/BCF (pH 7.4): 1354.84
ACD/KOC (pH 7.4): 6073.00
Polar Surface Area: 55 Å2
Polarizability: 39.4±0.5 10-24cm3
Surface Tension: 45.6±7.0 dyne/cm
Molar Volume: 280.5±7.0 cm3

Click to predict properties on the Chemicalize site


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