ChemSpider 2D Image | MFCD20274777 | C19H20O3

MFCD20274777

  • Molecular FormulaC19H20O3
  • Average mass296.360 Da
  • Monoisotopic mass296.141235 Da
  • ChemSpider ID22912888
  • Double-bond stereo - Double-bond stereo


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

(4E)-1,7-Bis(4-hydroxyphenyl)-4-hepten-3-on [German] [ACD/IUPAC Name]
(4E)-1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one [ACD/IUPAC Name]
(4E)-1,7-Bis(4-hydroxyphényl)-4-heptén-3-one [French] [ACD/IUPAC Name]
(4E)-1,7-bis(4-hydroxyphenyl)hept-4-en-3-one
1,7-Bis(4-hydroxyphenyl)-4-hepten-3-one
4-Hepten-3-one, 1,7-bis(4-hydroxyphenyl)-, (4E)- [ACD/Index Name]
56973-65-0 [RN]
MFCD20274777
(E)-1,7-bis(4-hydroxyphenyl)hept-4-en-3-one
(E)-1,7-Bis-(4-hydroxy-phenyl)-hept-4-en-3-one
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 529.1±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 83.4±3.0 kJ/mol
    Flash Point: 287.9±26.6 °C
    Index of Refraction: 1.606
    Molar Refractivity: 87.3±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 3.36
    ACD/LogD (pH 5.5): 3.25
    ACD/BCF (pH 5.5): 174.08
    ACD/KOC (pH 5.5): 1398.07
    ACD/LogD (pH 7.4): 3.25
    ACD/BCF (pH 7.4): 173.23
    ACD/KOC (pH 7.4): 1391.23
    Polar Surface Area: 58 Å2
    Polarizability: 34.6±0.5 10-24cm3
    Surface Tension: 51.3±3.0 dyne/cm
    Molar Volume: 253.1±3.0 cm3

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