ChemSpider 2D Image | (3E,5E)-3,5-Bis[4-(diethoxymethyl)benzylidene]tetrahydro-4H-pyran-4-one | C29H36O6

(3E,5E)-3,5-Bis[4-(diethoxymethyl)benzylidene]tetrahydro-4H-pyran-4-one

  • Molecular FormulaC29H36O6
  • Average mass480.592 Da
  • Monoisotopic mass480.251190 Da
  • ChemSpider ID34219244

  • Double-bond stereo - Double-bond stereo

More details:

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

(3E,5E)-3,5-Bis[4-(diethoxymethyl)benzyliden]tetrahydro-4H-pyran-4-on [German] [ACD/IUPAC Name]
(3E,5E)-3,5-Bis[4-(diethoxymethyl)benzylidene]tetrahydro-4H-pyran-4-one [ACD/IUPAC Name]
(3E,5E)-3,5-Bis[4-(diéthoxyméthyl)benzylidène]tétrahydro-4H-pyran-4-one [French] [ACD/IUPAC Name]
4H-Pyran-4-one, 3,5-bis[[4-(diethoxymethyl)phenyl]methylene]tetrahydro-, (3E,5E)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 596.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.9±3.0 kJ/mol
Flash Point: 251.7±30.2 °C
Index of Refraction: 1.579
Molar Refractivity: 140.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 7.04
ACD/LogD (pH 5.5): 5.65
ACD/BCF (pH 5.5): 11600.24
ACD/KOC (pH 5.5): 28244.50
ACD/LogD (pH 7.4): 5.65
ACD/BCF (pH 7.4): 11600.24
ACD/KOC (pH 7.4): 28244.50
Polar Surface Area: 63 Å2
Polarizability: 55.5±0.5 10-24cm3
Surface Tension: 45.9±3.0 dyne/cm
Molar Volume: 421.2±3.0 cm3

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