ChemSpider 2D Image | [(1E,6E)-4-(Hydroxymethylene)-3,5-dioxo-1,6-heptadiene-1,7-diyl]bis-2-methoxy-4,1-phenylene diacetate | C26H24O9

[(1E,6E)-4-(Hydroxymethylene)-3,5-dioxo-1,6-heptadiene-1,7-diyl]bis-2-methoxy-4,1-phenylene diacetate

  • Molecular FormulaC26H24O9
  • Average mass480.463 Da
  • Monoisotopic mass480.142029 Da
  • ChemSpider ID26631706

  • Double-bond stereo - Double-bond stereo

More details:

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

[(1E,6E)-4-(Hydroxymethylen)-3,5-dioxo-1,6-heptadien-1,7-diyl]bis-2-methoxy-4,1-phenylen-diacetat [German] [ACD/IUPAC Name]
[(1E,6E)-4-(Hydroxymethylene)-3,5-dioxo-1,6-heptadiene-1,7-diyl]bis-2-methoxy-4,1-phenylene diacetate [ACD/IUPAC Name]
1,6-Heptadiene-3,5-dione, 1,7-bis[4-(acetyloxy)-3-methoxyphenyl]-4-(hydroxymethylene)-, (1E,6E)- [ACD/Index Name]
Diacétate de [(1E,6E)-4-(hydroxyméthylène)-3,5-dioxo-1,6-heptadiène-1,7-diyl]bis-2-méthoxy-4,1-phénylène [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 625.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.3±3.0 kJ/mol
Flash Point: 206.6±25.0 °C
Index of Refraction: 1.607
Molar Refractivity: 129.0±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 3.28
ACD/LogD (pH 5.5): -0.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 125 Å2
Polarizability: 51.2±0.5 10-24cm3
Surface Tension: 50.1±3.0 dyne/cm
Molar Volume: 373.7±3.0 cm3

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