ChemSpider 2D Image | (1E,4E,6E)-5-Hydroxy-1,7-bis(4-hydroxyphenyl)-1,4,6-heptatrien-3-one | C19H16O4

(1E,4E,6E)-5-Hydroxy-1,7-bis(4-hydroxyphenyl)-1,4,6-heptatrien-3-one

  • Molecular FormulaC19H16O4
  • Average mass308.328 Da
  • Monoisotopic mass308.104858 Da
  • ChemSpider ID57513069
  • Double-bond stereo - Double-bond stereo


More details:






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

(1E,4E,6E)-5-Hydroxy-1,7-bis(4-hydroxyphenyl)-1,4,6-heptatrien-3-on [German] [ACD/IUPAC Name]
(1E,4E,6E)-5-Hydroxy-1,7-bis(4-hydroxyphenyl)-1,4,6-heptatrien-3-one [ACD/IUPAC Name]
(1E,4E,6E)-5-Hydroxy-1,7-bis(4-hydroxyphényl)-1,4,6-heptatrién-3-one [French] [ACD/IUPAC Name]
1,4,6-Heptatrien-3-one, 5-hydroxy-1,7-bis(4-hydroxyphenyl)-, (1E,4E,6E)- [ACD/Index Name]
5-HYDROXY-1,7-BIS(4-HYDROXYPHENYL)HEPTA-1,4,6-TRIEN-3-ONE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 553.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.8±3.0 kJ/mol
Flash Point: 302.5±26.6 °C
Index of Refraction: 1.718
Molar Refractivity: 92.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.32
ACD/LogD (pH 5.5): 2.96
ACD/BCF (pH 5.5): 104.40
ACD/KOC (pH 5.5): 969.13
ACD/LogD (pH 7.4): 2.91
ACD/BCF (pH 7.4): 92.44
ACD/KOC (pH 7.4): 858.10
Polar Surface Area: 78 Å2
Polarizability: 36.5±0.5 10-24cm3
Surface Tension: 64.9±3.0 dyne/cm
Molar Volume: 233.7±3.0 cm3

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