ChemSpider 2D Image | Cevane-3-beta,4-beta,7-alpha,14,15-alpha,16-beta,20-heptol, 4,9-epoxy- | C27H43NO8

Cevane-3-β,4-β,7-α,14,15-α,16-β,20-heptol, 4,9-epoxy-

  • Molecular FormulaC27H43NO8
  • Average mass509.632 Da
  • Monoisotopic mass509.298859 Da
  • ChemSpider ID19953392
  • defined stereocentres - 16 of 16 defined stereocentres


More details:






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

(3β,4α,7α,15α,16β)-4,9-Epoxycevan-3,4,7,14,15,16,20-heptol [German] [ACD/IUPAC Name]
(3β,4α,7α,15α,16β)-4,9-Epoxycevane-3,4,7,14,15,16,20-heptol [ACD/IUPAC Name]
(3β,4α,7α,15α,16β)-4,9-Époxycévane-3,4,7,14,15,16,20-heptol [French] [ACD/IUPAC Name]
Cevane-3,4,7,14,15,16,20-heptol, 4,9-epoxy-, (3β,4α,7α,15α,16β)- [ACD/Index Name]
Cevane-3β,4β,7α,14,15α,16β,20-heptol, 4,9-epoxy-
Cevane-3-β,4-β,7-α,14,15-α,16-β,20-heptol, 4,9-epoxy-

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 688.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.9 mmHg at 25°C
Enthalpy of Vaporization: 115.4±6.0 kJ/mol
Flash Point: 370.0±31.5 °C
Index of Refraction: 1.680
Molar Refractivity: 128.9±0.4 cm3
#H bond acceptors: 9
#H bond donors: 7
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 2
ACD/LogP: -0.07
ACD/LogD (pH 5.5): -3.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.09
Polar Surface Area: 154 Å2
Polarizability: 51.1±0.5 10-24cm3
Surface Tension: 82.9±5.0 dyne/cm
Molar Volume: 341.4±5.0 cm3

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