ChemSpider 2D Image | (4R)-4-[(1S,2E)-1-Hydroxy-3,7-dimethyl-5-oxo-2,6-octadien-1-yl]-3-methylenedihydro-2(3H)-furanone | C15H20O4

(4R)-4-[(1S,2E)-1-Hydroxy-3,7-dimethyl-5-oxo-2,6-octadien-1-yl]-3-methylenedihydro-2(3H)-furanone

  • Molecular FormulaC15H20O4
  • Average mass264.317 Da
  • Monoisotopic mass264.136169 Da
  • ChemSpider ID28289824

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

Featured data source
Natural Product Updates

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

(4R)-4-[(1S,2E)-1-Hydroxy-3,7-dimethyl-5-oxo-2,6-octadien-1-yl]-3-methylendihydro-2(3H)-furanon [German] [ACD/IUPAC Name]
(4R)-4-[(1S,2E)-1-Hydroxy-3,7-dimethyl-5-oxo-2,6-octadien-1-yl]-3-methylenedihydro-2(3H)-furanone [ACD/IUPAC Name]
(4R)-4-[(1S,2E)-1-Hydroxy-3,7-diméthyl-5-oxo-2,6-octadién-1-yl]-3-méthylènedihydro-2(3H)-furanone [French] [ACD/IUPAC Name]
2(3H)-Furanone, dihydro-4-[(1S,2E)-1-hydroxy-3,7-dimethyl-5-oxo-2,6-octadien-1-yl]-3-methylene-, (4R)- [ACD/Index Name]
syn-hydroxyanthecotulide

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

Density: 1.1±0.1 g/cm3
Boiling Point: 461.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 83.3±6.0 kJ/mol
Flash Point: 170.4±22.2 °C
Index of Refraction: 1.516
Molar Refractivity: 71.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.43
ACD/LogD (pH 5.5): 2.49
ACD/BCF (pH 5.5): 46.28
ACD/KOC (pH 5.5): 541.62
ACD/LogD (pH 7.4): 2.49
ACD/BCF (pH 7.4): 46.28
ACD/KOC (pH 7.4): 541.62
Polar Surface Area: 64 Å2
Polarizability: 28.5±0.5 10-24cm3
Surface Tension: 40.1±5.0 dyne/cm
Molar Volume: 237.7±5.0 cm3

Click to predict properties on the Chemicalize site


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