ChemSpider 2D Image | 3-(Hexopyranosyloxy)bufa-4,20,22-trienolide | C30H42O8

3-(Hexopyranosyloxy)bufa-4,20,22-trienolide

  • Molecular FormulaC30H42O8
  • Average mass530.650 Da
  • Monoisotopic mass530.287964 Da
  • ChemSpider ID385314

More details:

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

3-(Hexopyranosyloxy)bufa-4,20,22-trienolid [German] [ACD/IUPAC Name]
3-(Hexopyranosyloxy)bufa-4,20,22-trienolide [ACD/IUPAC Name]
3-(Hexopyranosyloxy)bufa-4,20,22-triénolide [French] [ACD/IUPAC Name]
Bufa-4,20,22-trienolide, 3-(hexopyranosyloxy)- [ACD/Index Name]

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

NSC374119 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 727.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.4 mmHg at 25°C
Enthalpy of Vaporization: 121.3±6.0 kJ/mol
Flash Point: 236.6±26.4 °C
Index of Refraction: 1.619
Molar Refractivity: 139.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 3.16
ACD/LogD (pH 5.5): 2.70
ACD/BCF (pH 5.5): 66.64
ACD/KOC (pH 5.5): 703.15
ACD/LogD (pH 7.4): 2.70
ACD/BCF (pH 7.4): 66.64
ACD/KOC (pH 7.4): 703.15
Polar Surface Area: 126 Å2
Polarizability: 55.2±0.5 10-24cm3
Surface Tension: 62.6±5.0 dyne/cm
Molar Volume: 397.0±5.0 cm3

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