ChemSpider 2D Image | (5beta,9xi,10alpha,14beta)-8,14:12,16-Diepoxyabieta-11,13(15)-dien-16-one | C20H26O3

(5β,9ξ,10α,14β)-8,14:12,16-Diepoxyabieta-11,13(15)-dien-16-one

  • Molecular FormulaC20H26O3
  • Average mass314.419 Da
  • Monoisotopic mass314.188202 Da
  • ChemSpider ID74171843

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

(5β,9ξ,10α,14β)-8,14:12,16-Diepoxyabieta-11,13(15)-dien-16-on [German] [ACD/IUPAC Name]
(5β,9ξ,10α,14β)-8,14:12,16-Diepoxyabieta-11,13(15)-dien-16-one [ACD/IUPAC Name]
(5β,9ξ,10α,14β)-8,14:12,16-Diépoxyabiéta-11,13(15)-dién-16-one [French] [ACD/IUPAC Name]
2H-Oxireno[1,10a]phenanthro[3,2-b]furan-10(11bH)-one, 3,3a,4,5,6,7,7a,7b-octahydro-4,4,7a,11-tetramethyl-, (1aS,3aR,7aR,11bR)- [ACD/Index 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: 479.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.4±3.0 kJ/mol
Flash Point: 206.7±23.3 °C
Index of Refraction: 1.579
Molar Refractivity: 87.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.70
ACD/LogD (pH 5.5): 4.57
ACD/BCF (pH 5.5): 1747.27
ACD/KOC (pH 5.5): 7285.82
ACD/LogD (pH 7.4): 4.57
ACD/BCF (pH 7.4): 1747.27
ACD/KOC (pH 7.4): 7285.82
Polar Surface Area: 39 Å2
Polarizability: 34.5±0.5 10-24cm3
Surface Tension: 44.4±5.0 dyne/cm
Molar Volume: 262.0±5.0 cm3

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