ChemSpider 2D Image | (10xi,13xi,25R)-Spirost-4-en-3,6-dione | C27H38O4

(10ξ,13ξ,25R)-Spirost-4-en-3,6-dione

  • Molecular FormulaC27H38O4
  • Average mass426.588 Da
  • Monoisotopic mass426.277008 Da
  • ChemSpider ID58817117

  • defined stereocentres - 8 of 10 defined stereocentres

More details:

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

(10ξ,13ξ,25R)-Spirost-4-en-3,6-dion [German] [ACD/IUPAC Name]
(10ξ,13ξ,25R)-Spirost-4-en-3,6-dione [ACD/IUPAC Name]
(10ξ,13ξ,25R)-Spirost-4-én-3,6-dione [French] [ACD/IUPAC Name]
Spirost-4-en-3,6-dione, (10ξ,13ξ,25R)- [ACD/Index Name]
3730-84-5 [RN]
DIOSGENIN OXIDATION PRODUCT

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

Density: 1.2±0.1 g/cm3
Boiling Point: 553.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.4±3.0 kJ/mol
Flash Point: 236.6±30.2 °C
Index of Refraction: 1.565
Molar Refractivity: 118.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.61
ACD/LogD (pH 5.5): 3.80
ACD/BCF (pH 5.5): 455.38
ACD/KOC (pH 5.5): 2782.69
ACD/LogD (pH 7.4): 3.80
ACD/BCF (pH 7.4): 455.38
ACD/KOC (pH 7.4): 2782.69
Polar Surface Area: 53 Å2
Polarizability: 46.8±0.5 10-24cm3
Surface Tension: 46.0±5.0 dyne/cm
Molar Volume: 362.6±5.0 cm3

Click to predict properties on the Chemicalize site


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