ChemSpider 2D Image | (2''R,3S,4''R,4a''S,5'R,8a''S)-4''-Hydroxy-2'',5'',5'',8a''-tetramethyldecahydro-2''H-dispiro[furan-3,2'-furan-5',1''-naphthalen]-5(4H)-one | C20H32O4

(2''R,3S,4''R,4a''S,5'R,8a''S)-4''-Hydroxy-2'',5'',5'',8a''-tetramethyldecahydro-2''H-dispiro[furan-3,2'-furan-5',1''-naphthalen]-5(4H)-one

  • Molecular FormulaC20H32O4
  • Average mass336.466 Da
  • Monoisotopic mass336.230072 Da
  • ChemSpider ID30827570

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(2''R,3S,4''R,4a''S,5'R,8a''S)-4''-Hydroxy-2'',5'',5'',8a''-tetramethyldecahydro-2''H-dispiro[furan-3,2'-furan-5',1''-naphthalen]-5(4H)-on [German] [ACD/IUPAC Name]
(2''R,3S,4''R,4a''S,5'R,8a''S)-4''-Hydroxy-2'',5'',5'',8a''-tetramethyldecahydro-2''H-dispiro[furan-3,2'-furan-5',1''-naphthalen]-5(4H)-one [ACD/IUPAC Name]
(2''R,3S,4''R,4a''S,5'R,8a''S)-4''-Hydroxy-2'',5'',5'',8a''-tétraméthyldécahydro-2''H-dispiro[furan-3,2'-furan-5',1''-naphthalen]-5(4H)-one [French] [ACD/IUPAC Name]
Dispiro[furan-3(2H),2'(5'H)-furan-5',1''(2''H)-naphthalen]-5(4H)-one, decahydro-4''-hydroxy-2'',5'',5'',8''a-tetramethyl-, (2''R,3S,4''R,4a''S,5'R,8a''S)- [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: 491.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 87.3±6.0 kJ/mol
Flash Point: 170.2±22.2 °C
Index of Refraction: 1.539
Molar Refractivity: 91.6±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.12
ACD/LogD (pH 5.5): 3.04
ACD/BCF (pH 5.5): 119.53
ACD/KOC (pH 5.5): 1068.21
ACD/LogD (pH 7.4): 3.04
ACD/BCF (pH 7.4): 119.53
ACD/KOC (pH 7.4): 1068.21
Polar Surface Area: 56 Å2
Polarizability: 36.3±0.5 10-24cm3
Surface Tension: 44.5±5.0 dyne/cm
Molar Volume: 292.4±5.0 cm3

Click to predict properties on the Chemicalize site


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