ChemSpider 2D Image | 3-(1,3-Benzodioxol-5-yl)-5-methoxy-5-(4-methoxyphenyl)-4-(3,4,5-trimethoxybenzyl)-2(5H)-furanone | C29H28O9

3-(1,3-Benzodioxol-5-yl)-5-methoxy-5-(4-methoxyphenyl)-4-(3,4,5-trimethoxybenzyl)-2(5H)-furanone

  • Molecular FormulaC29H28O9
  • Average mass520.527 Da
  • Monoisotopic mass520.173340 Da
  • ChemSpider ID8753264

More details:

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

2(5H)-Furanone, 3-(1,3-benzodioxol-5-yl)-5-methoxy-5-(4-methoxyphenyl)-4-[(3,4,5-trimethoxyphenyl)methyl]- [ACD/Index Name]
3-(1,3-Benzodioxol-5-yl)-5-methoxy-5-(4-methoxyphenyl)-4-(3,4,5-trimethoxybenzyl)-2(5H)-furanon [German] [ACD/IUPAC Name]
3-(1,3-Benzodioxol-5-yl)-5-methoxy-5-(4-methoxyphenyl)-4-(3,4,5-trimethoxybenzyl)-2(5H)-furanone [ACD/IUPAC Name]
3-(1,3-Benzodioxol-5-yl)-5-méthoxy-5-(4-méthoxyphényl)-4-(3,4,5-triméthoxybenzyl)-2(5H)-furanone [French] [ACD/IUPAC Name]
3-(1,3-benzodioxol-5-yl)-5-methoxy-5-(4-methoxyphenyl)-4-(3,4,5-trimethoxybenzyl)furan-2(5H)-one
3-Benzo[1,3]dioxol-5-yl-5-methoxy-5-(4-methoxy-phenyl)-4-(3,4,5-trimethoxy-benzyl)-5H-furan-2-one

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

Density: 1.3±0.1 g/cm3
Boiling Point: 695.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.9±3.0 kJ/mol
Flash Point: 294.4±31.5 °C
Index of Refraction: 1.624
Molar Refractivity: 136.5±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.85
ACD/LogD (pH 5.5): 3.69
ACD/BCF (pH 5.5): 377.27
ACD/KOC (pH 5.5): 2432.05
ACD/LogD (pH 7.4): 3.69
ACD/BCF (pH 7.4): 377.27
ACD/KOC (pH 7.4): 2432.05
Polar Surface Area: 91 Å2
Polarizability: 54.1±0.5 10-24cm3
Surface Tension: 58.0±5.0 dyne/cm
Molar Volume: 386.5±5.0 cm3

Click to predict properties on the Chemicalize site


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