ChemSpider 2D Image | 3-(3,5-Dimethylphenoxy)-4-oxo-4H-chromen-7-yl (2E)-3-(3,4-diethoxyphenyl)acrylate | C30H28O7

3-(3,5-Dimethylphenoxy)-4-oxo-4H-chromen-7-yl (2E)-3-(3,4-diethoxyphenyl)acrylate

  • Molecular FormulaC30H28O7
  • Average mass500.539 Da
  • Monoisotopic mass500.183502 Da
  • ChemSpider ID1314507

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-(3,4-Diéthoxyphényl)acrylate de 3-(3,5-diméthylphénoxy)-4-oxo-4H-chromén-7-yle [French] [ACD/IUPAC Name]
2-Propenoic acid, 3-(3,4-diethoxyphenyl)-, 3-(3,5-dimethylphenoxy)-4-oxo-4H-1-benzopyran-7-yl ester, (2E)- [ACD/Index Name]
3-(3,5-Dimethylphenoxy)-4-oxo-4H-chromen-7-yl (2E)-3-(3,4-diethoxyphenyl)acrylate [ACD/IUPAC Name]
3-(3,5-Dimethylphenoxy)-4-oxo-4H-chromen-7-yl-(2E)-3-(3,4-diethoxyphenyl)acrylat [German] [ACD/IUPAC Name]
(E)-3-(3,5-dimethylphenoxy)-4-oxo-4H-chromen-7-yl 3-(3,4-diethoxyphenyl)acrylate
3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl (2E)-3-(3,4-diethoxyphenyl)prop-2-enoate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 656.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.7±3.0 kJ/mol
Flash Point: 278.0±31.5 °C
Index of Refraction: 1.611
Molar Refractivity: 140.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 7.57
ACD/LogD (pH 5.5): 5.94
ACD/BCF (pH 5.5): 19305.04
ACD/KOC (pH 5.5): 40669.57
ACD/LogD (pH 7.4): 5.94
ACD/BCF (pH 7.4): 19305.04
ACD/KOC (pH 7.4): 40669.57
Polar Surface Area: 80 Å2
Polarizability: 55.7±0.5 10-24cm3
Surface Tension: 49.9±3.0 dyne/cm
Molar Volume: 404.6±3.0 cm3

Click to predict properties on the Chemicalize site


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