ChemSpider 2D Image | (1'S,4R,4'R,9'R,10'R,13'R)-2,2,5',5',9'-Pentamethylspiro[1,3-dioxolane-4,14'-tetracyclo[11.2.1.0~1,10~.0~4,9~]hexadecane] | C23H38O2

(1'S,4R,4'R,9'R,10'R,13'R)-2,2,5',5',9'-Pentamethylspiro[1,3-dioxolane-4,14'-tetracyclo[11.2.1.01,10.04,9]hexadecane]

  • Molecular FormulaC23H38O2
  • Average mass346.547 Da
  • Monoisotopic mass346.287170 Da
  • ChemSpider ID28424392

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(1'S,4R,4'R,9'R,10'R,13'R)-2,2,5',5',9'-Pentamethylspiro[1,3-dioxolane-4,14'-tetracyclo[11.2.1.01,10.04,9]hexadecane] [ACD/IUPAC Name]
[58493-71-3] [RN]
58493-71-3 [RN]
ent-16β,17-Isopropylidenedioxykaurane
ent-16β,17-Isopropylidenedioxykaurane
ent-16β,17-Isopropylidenedioxykaurane
MFCD17214874

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

Density: 1.1±0.1 g/cm3
Boiling Point: 420.2±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 64.8±3.0 kJ/mol
Flash Point: 232.0±17.4 °C
Index of Refraction: 1.532
Molar Refractivity: 101.8±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 7.38
ACD/LogD (pH 5.5): 7.00
ACD/BCF (pH 5.5): 122895.83
ACD/KOC (pH 5.5): 152991.94
ACD/LogD (pH 7.4): 7.00
ACD/BCF (pH 7.4): 122895.83
ACD/KOC (pH 7.4): 152991.94
Polar Surface Area: 18 Å2
Polarizability: 40.4±0.5 10-24cm3
Surface Tension: 38.9±5.0 dyne/cm
Molar Volume: 328.3±5.0 cm3

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