ChemSpider 2D Image | 3,7-Dimethyl-8-oxo-7-propionylbicyclo[4.2.0]octa-1,3,5-trien-2-yl acetate | C15H16O4

3,7-Dimethyl-8-oxo-7-propionylbicyclo[4.2.0]octa-1,3,5-trien-2-yl acetate

  • Molecular FormulaC15H16O4
  • Average mass260.285 Da
  • Monoisotopic mass260.104858 Da
  • ChemSpider ID31122450

More details:

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

3,7-Dimethyl-8-oxo-7-propionylbicyclo[4.2.0]octa-1,3,5-trien-2-yl acetate [ACD/IUPAC Name]
3,7-Dimethyl-8-oxo-7-propionylbicyclo[4.2.0]octa-1,3,5-trien-2-yl-acetat [German] [ACD/IUPAC Name]
Acétate de 3,7-diméthyl-8-oxo-7-propionylbicyclo[4.2.0]octa-1,3,5-trién-2-yle [French] [ACD/IUPAC Name]
Bicyclo[4.2.0]octa-1,3,5-trien-7-one, 5-(acetyloxy)-4,8-dimethyl-8-(1-oxopropyl)- [ACD/Index Name]
Phyllostoxin

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

Density: 1.2±0.1 g/cm3
Boiling Point: 423.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.8±3.0 kJ/mol
Flash Point: 188.8±28.8 °C
Index of Refraction: 1.543
Molar Refractivity: 68.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.02
ACD/LogD (pH 5.5): 2.12
ACD/BCF (pH 5.5): 24.22
ACD/KOC (pH 5.5): 340.75
ACD/LogD (pH 7.4): 2.12
ACD/BCF (pH 7.4): 24.22
ACD/KOC (pH 7.4): 340.75
Polar Surface Area: 60 Å2
Polarizability: 27.2±0.5 10-24cm3
Surface Tension: 44.5±3.0 dyne/cm
Molar Volume: 217.4±3.0 cm3

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