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

(2E,4E)-1-(4-Methylphenyl)-5-(2-thienyl)-2,4-pentadien-1-one

  • Molecular FormulaC16H14OS
  • Average mass254.347 Da
  • Monoisotopic mass254.076538 Da
  • ChemSpider ID26050523

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E,4E)-1-(4-Methylphenyl)-5-(2-thienyl)-2,4-pentadien-1-on [German] [ACD/IUPAC Name]
(2E,4E)-1-(4-Methylphenyl)-5-(2-thienyl)-2,4-pentadien-1-one [ACD/IUPAC Name]
(2E,4E)-1-(4-Méthylphényl)-5-(2-thiényl)-2,4-pentadién-1-one [French] [ACD/IUPAC Name]
2,4-Pentadien-1-one, 1-(4-methylphenyl)-5-(2-thienyl)-, (2E,4E)- [ACD/Index Name]
(2E,4E)-1-(4-methylphenyl)-5-(thiophen-2-yl)penta-2,4-dien-1-one
(2E,4E)-1-(4-methylphenyl)-5-thiophen-2-ylpenta-2,4-dien-1-one
35532-97-9 [RN]
5-Thiophen-2-yl-1-p-tolyl-penta-2,4-dien-1-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: 420.7±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 67.5±3.0 kJ/mol
    Flash Point: 208.3±28.7 °C
    Index of Refraction: 1.636
    Molar Refractivity: 79.6±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.08
    ACD/LogD (pH 5.5): 4.10
    ACD/BCF (pH 5.5): 763.14
    ACD/KOC (pH 5.5): 4026.90
    ACD/LogD (pH 7.4): 4.10
    ACD/BCF (pH 7.4): 763.14
    ACD/KOC (pH 7.4): 4026.90
    Polar Surface Area: 45 Å2
    Polarizability: 31.6±0.5 10-24cm3
    Surface Tension: 46.0±3.0 dyne/cm
    Molar Volume: 222.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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