ChemSpider 2D Image | (5'R,8'S,9'R,10'R,13'R,14'R)-10',13'-Dimethyltetradecahydro-2'H-dispiro[1,3-dioxolane-2,17'-cyclopenta[a]phenanthrene-3',2''-[1,3]dioxolane] | C23H36O4

(5'R,8'S,9'R,10'R,13'R,14'R)-10',13'-Dimethyltetradecahydro-2'H-dispiro[1,3-dioxolane-2,17'-cyclopenta[a]phenanthrene-3',2''-[1,3]dioxolane]

  • Molecular FormulaC23H36O4
  • Average mass376.530 Da
  • Monoisotopic mass376.261353 Da
  • ChemSpider ID113597960

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(5'R,8'S,9'R,10'R,13'R,14'R)-10',13'-Dimethyltetradecahydro-2'H-dispiro[1,3-dioxolane-2,17'-cyclopenta[a]phenanthrene-3',2''-[1,3]dioxolane] [ACD/IUPAC Name]
Dispiro[1,3-dioxolane-2,17'-[3H]cyclopenta[a]phenanthrene-3'(2'H),2''-[1,3]dioxolane], tetradecahydro-10',13'-dimethyl-, (5'R,8'S,9'R,10'R,13'R,14'R)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 476.8±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.2±3.0 kJ/mol
Flash Point: 120.6±31.4 °C
Index of Refraction: 1.554
Molar Refractivity: 103.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.35
ACD/LogD (pH 5.5): 3.91
ACD/BCF (pH 5.5): 547.51
ACD/KOC (pH 5.5): 3175.01
ACD/LogD (pH 7.4): 3.91
ACD/BCF (pH 7.4): 547.51
ACD/KOC (pH 7.4): 3175.01
Polar Surface Area: 37 Å2
Polarizability: 40.9±0.5 10-24cm3
Surface Tension: 44.8±5.0 dyne/cm
Molar Volume: 321.8±5.0 cm3

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