ChemSpider 2D Image | (7alpha,14R)-14-Hydroxy-7,10-epoxygrayanotoxa-1(5),16-diene-2,15-dione | C20H24O4

(7α,14R)-14-Hydroxy-7,10-epoxygrayanotoxa-1(5),16-diene-2,15-dione

  • Molecular FormulaC20H24O4
  • Average mass328.402 Da
  • Monoisotopic mass328.167450 Da
  • ChemSpider ID24672707

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

Featured data source
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(7α,14R)-14-Hydroxy-7,10-epoxygrayanotoxa-1(5),16-dien-2,15-dion [German] [ACD/IUPAC Name]
(7α,14R)-14-Hydroxy-7,10-epoxygrayanotoxa-1(5),16-diene-2,15-dione [ACD/IUPAC Name]
(7α,14R)-14-Hydroxy-7,10-époxygrayanotoxa-1(5),16-diène-2,15-dione [French] [ACD/IUPAC Name]
Grayanotoxa-1(5),16-diene-2,15-dione, 7,10-epoxy-14-hydroxy-, (7α,14R)- [ACD/Index Name]
CROTONKINENSIN A

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

Density: 1.3±0.1 g/cm3
Boiling Point: 531.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 92.8±6.0 kJ/mol
Flash Point: 192.1±23.6 °C
Index of Refraction: 1.603
Molar Refractivity: 86.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.48
ACD/LogD (pH 5.5): 1.73
ACD/BCF (pH 5.5): 12.12
ACD/KOC (pH 5.5): 207.55
ACD/LogD (pH 7.4): 1.73
ACD/BCF (pH 7.4): 12.12
ACD/KOC (pH 7.4): 207.55
Polar Surface Area: 64 Å2
Polarizability: 34.4±0.5 10-24cm3
Surface Tension: 51.7±5.0 dyne/cm
Molar Volume: 252.8±5.0 cm3

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