ChemSpider 2D Image | (1aR,3S,5aR,8aR,9R)-4,10a-Dimethyl-8-methylene-7-oxo-1a,2,3,5a,7,8,8a,9,10,10a-decahydrooxireno[5,6]cyclodeca[1,2-b]furan-3,9-diyl bis(2-methylacrylate) | C23H28O7

(1aR,3S,5aR,8aR,9R)-4,10a-Dimethyl-8-methylene-7-oxo-1a,2,3,5a,7,8,8a,9,10,10a-decahydrooxireno[5,6]cyclodeca[1,2-b]furan-3,9-diyl bis(2-methylacrylate)

  • Molecular FormulaC23H28O7
  • Average mass416.464 Da
  • Monoisotopic mass416.183502 Da
  • ChemSpider ID78315919

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 5 of 6 defined stereocentres

More details:

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

(1aR,3S,5aR,8aR,9R)-4,10a-Dimethyl-8-methylen-7-oxo-1a,2,3,5a,7,8,8a,9,10,10a-decahydrooxireno[5,6]cyclodeca[1,2-b]furan-3,9-diyl-bis(2-methylacrylat) [German] [ACD/IUPAC Name]
(1aR,3S,5aR,8aR,9R)-4,10a-Dimethyl-8-methylene-7-oxo-1a,2,3,5a,7,8,8a,9,10,10a-decahydrooxireno[5,6]cyclodeca[1,2-b]furan-3,9-diyl bis(2-methylacrylate) [ACD/IUPAC Name]
2-Propenoic acid, 2-methyl-, (1aR,3S,5aR,8aR,9R)-1a,2,3,5a,7,8,8a,9,10,10a-decahydro-4,10a-dimethyl-8-methylene-7-oxooxireno[5,6]cyclodeca[1,2-b]furan-3,9-diyl ester [ACD/Index Name]
Bis(2-méthylacrylate) de (1aR,3S,5aR,8aR,9R)-4,10a-diméthyl-8-méthylène-7-oxo-1a,2,3,5a,7,8,8a,9,10,10a-décahydrooxiréno[5,6]cyclodéca[1,2-b]furane-3,9-diyle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 544.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.3±3.0 kJ/mol
Flash Point: 234.9±30.2 °C
Index of Refraction: 1.535
Molar Refractivity: 107.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.14
ACD/LogD (pH 5.5): 3.44
ACD/BCF (pH 5.5): 243.83
ACD/KOC (pH 5.5): 1779.43
ACD/LogD (pH 7.4): 3.44
ACD/BCF (pH 7.4): 243.83
ACD/KOC (pH 7.4): 1779.43
Polar Surface Area: 91 Å2
Polarizability: 42.8±0.5 10-24cm3
Surface Tension: 42.6±5.0 dyne/cm
Molar Volume: 346.7±5.0 cm3

Click to predict properties on the Chemicalize site


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