ChemSpider 2D Image | (1E,4E)-1,5-Di(9-phenanthryl)-1,4-pentadien-3-one | C33H22O

(1E,4E)-1,5-Di(9-phenanthryl)-1,4-pentadien-3-one

  • Molecular FormulaC33H22O
  • Average mass434.527 Da
  • Monoisotopic mass434.167053 Da
  • ChemSpider ID28190813
  • Double-bond stereo - Double-bond stereo


More details:






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

(1E,4E)-1,5-Di(9-phenanthryl)-1,4-pentadien-3-on [German] [ACD/IUPAC Name]
(1E,4E)-1,5-Di(9-phenanthryl)-1,4-pentadien-3-one [ACD/IUPAC Name]
(1E,4E)-1,5-Di(9-phénanthryl)-1,4-pentadién-3-one [French] [ACD/IUPAC Name]
1,4-Pentadien-3-one, 1,5-di-9-phenanthrenyl-, (1E,4E)- [ACD/Index Name]
(1E4E)-1,5-Di(9-phenanthryl)-1,4-pentadien-3-one

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

Density: 1.2±0.1 g/cm3
Boiling Point: 711.0±49.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.0±3.0 kJ/mol
Flash Point: 306.4±24.8 °C
Index of Refraction: 1.798
Molar Refractivity: 149.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 9.80
ACD/LogD (pH 5.5): 8.65
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1217721.38
ACD/LogD (pH 7.4): 8.65
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1217721.38
Polar Surface Area: 17 Å2
Polarizability: 59.1±0.5 10-24cm3
Surface Tension: 59.2±3.0 dyne/cm
Molar Volume: 349.4±3.0 cm3

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