ChemSpider 2D Image | (2E,4Z)-1,5-Bis(3,4-dihydroxyphenyl)-2,4-pentadien-1-one | C17H14O5

(2E,4Z)-1,5-Bis(3,4-dihydroxyphenyl)-2,4-pentadien-1-one

  • Molecular FormulaC17H14O5
  • Average mass298.290 Da
  • Monoisotopic mass298.084137 Da
  • ChemSpider ID28287440

  • Double-bond stereo - Double-bond stereo

More details:

Featured data source
Natural Product Updates

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

(2E,4Z)-1,5-Bis(3,4-dihydroxyphenyl)-2,4-pentadien-1-on [German] [ACD/IUPAC Name]
(2E,4Z)-1,5-Bis(3,4-dihydroxyphenyl)-2,4-pentadien-1-one [ACD/IUPAC Name]
(2E,4Z)-1,5-Bis(3,4-dihydroxyphényl)-2,4-pentadién-1-one [French] [ACD/IUPAC Name]
2,4-Pentadien-1-one, 1,5-bis(3,4-dihydroxyphenyl)-, (2E,4Z)- [ACD/Index Name]
sinensigenin B

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

Density: 1.4±0.1 g/cm3
Boiling Point: 615.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.7±3.0 kJ/mol
Flash Point: 340.1±28.0 °C
Index of Refraction: 1.731
Molar Refractivity: 84.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.93
ACD/LogD (pH 5.5): 2.12
ACD/BCF (pH 5.5): 24.14
ACD/KOC (pH 5.5): 339.22
ACD/LogD (pH 7.4): 1.93
ACD/BCF (pH 7.4): 15.44
ACD/KOC (pH 7.4): 217.00
Polar Surface Area: 98 Å2
Polarizability: 33.3±0.5 10-24cm3
Surface Tension: 74.7±3.0 dyne/cm
Molar Volume: 210.2±3.0 cm3

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