ChemSpider 2D Image | (1E,4E)-1-(5-Methyl-2-thienyl)-5-phenyl-1,4-pentadien-3-one | C16H14OS

(1E,4E)-1-(5-Methyl-2-thienyl)-5-phenyl-1,4-pentadien-3-one

  • Molecular FormulaC16H14OS
  • Average mass254.347 Da
  • Monoisotopic mass254.076538 Da
  • ChemSpider ID62232638

  • Double-bond stereo - Double-bond stereo

More details:

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

(1E,4E)-1-(5-Methyl-2-thienyl)-5-phenyl-1,4-pentadien-3-on [German] [ACD/IUPAC Name]
(1E,4E)-1-(5-Methyl-2-thienyl)-5-phenyl-1,4-pentadien-3-one [ACD/IUPAC Name]
(1E,4E)-1-(5-Méthyl-2-thiényl)-5-phényl-1,4-pentadién-3-one [French] [ACD/IUPAC Name]
1,4-Pentadien-3-one, 1-(5-methyl-2-thienyl)-5-phenyl-, (1E,4E)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 418.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.2±3.0 kJ/mol
Flash Point: 206.9±28.7 °C
Index of Refraction: 1.661
Molar Refractivity: 80.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.15
ACD/LogD (pH 5.5): 4.25
ACD/BCF (pH 5.5): 999.72
ACD/KOC (pH 5.5): 4885.54
ACD/LogD (pH 7.4): 4.25
ACD/BCF (pH 7.4): 999.72
ACD/KOC (pH 7.4): 4885.54
Polar Surface Area: 45 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 47.6±3.0 dyne/cm
Molar Volume: 218.6±3.0 cm3

Click to predict properties on the Chemicalize site


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