ChemSpider 2D Image | 3-Acetoxy-16-(butyryloxy)-14,15-epoxybufa-20,22-dienolide | C30H40O7

3-Acetoxy-16-(butyryloxy)-14,15-epoxybufa-20,22-dienolide

  • Molecular FormulaC30H40O7
  • Average mass512.634 Da
  • Monoisotopic mass512.277405 Da
  • ChemSpider ID283599

More details:

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

3-Acetoxy-16-(butyryloxy)-14,15-epoxybufa-20,22-dienolid [German] [ACD/IUPAC Name]
3-Acetoxy-16-(butyryloxy)-14,15-epoxybufa-20,22-dienolide [ACD/IUPAC Name]
3-Acétoxy-16-(butyryloxy)-14,15-époxybufa-20,22-diénolide [French] [ACD/IUPAC Name]
Bufa-20,22-dienolide, 3-(acetyloxy)-14,15-epoxy-16-(1-oxobutoxy)- [ACD/Index Name]
76685-42-2 [RN]

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

NSC267901 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 618.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.7±3.0 kJ/mol
Flash Point: 260.4±31.5 °C
Index of Refraction: 1.570
Molar Refractivity: 135.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 4.39
ACD/LogD (pH 5.5): 4.47
ACD/BCF (pH 5.5): 1463.55
ACD/KOC (pH 5.5): 6417.97
ACD/LogD (pH 7.4): 4.47
ACD/BCF (pH 7.4): 1463.55
ACD/KOC (pH 7.4): 6417.97
Polar Surface Area: 91 Å2
Polarizability: 53.7±0.5 10-24cm3
Surface Tension: 50.0±5.0 dyne/cm
Molar Volume: 413.0±5.0 cm3

Click to predict properties on the Chemicalize site


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