ChemSpider 2D Image | euniolide | C20H28O3

euniolide

  • Molecular FormulaC20H28O3
  • Average mass316.435 Da
  • Monoisotopic mass316.203857 Da
  • ChemSpider ID27026073

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(1aR,4E,8E,10aS,13aS,14aR)-1a,5,9-Trimethyl-13-methylen-2,3,6,7,10,10a,13,13a,14,14a-decahydrooxireno[4,5]cyclotetradeca[1,2-b]furan-12(1aH)-on [German] [ACD/IUPAC Name]
(1aR,4E,8E,10aS,13aS,14aR)-1a,5,9-Trimethyl-13-methylene-2,3,6,7,10,10a,13,13a,14,14a-decahydrooxireno[4,5]cyclotetradeca[1,2-b]furan-12(1aH)-one [ACD/IUPAC Name]
(1aR,4E,8E,10aS,13aS,14aR)-1a,5,9-Triméthyl-13-méthylène-2,3,6,7,10,10a,13,13a,14,14a-décahydrooxiréno[4,5]cyclotétradéca[1,2-b]furan-12(1aH)-one [French] [ACD/IUPAC Name]
euniolide
Oxireno[4,5]cyclotetradeca[1,2-b]furan-12(1aH)-one, 2,3,6,7,10,10a,13,13a,14,14a-decahydro-1a,5,9-trimethyl-13-methylene-, (1aR,4E,8E,10aS,13aS,14aR)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 464.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.6±3.0 kJ/mol
Flash Point: 199.5±23.3 °C
Index of Refraction: 1.531
Molar Refractivity: 91.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.73
ACD/LogD (pH 5.5): 4.72
ACD/BCF (pH 5.5): 2286.30
ACD/KOC (pH 5.5): 8832.09
ACD/LogD (pH 7.4): 4.72
ACD/BCF (pH 7.4): 2286.30
ACD/KOC (pH 7.4): 8832.09
Polar Surface Area: 39 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 38.4±5.0 dyne/cm
Molar Volume: 294.1±5.0 cm3

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