ChemSpider 2D Image | (3aR,4S,7S,7aR)-7-Hydroxy-2,2,4,7-tetramethyltetrahydro-6H-[1,3]dioxolo[4,5-c]pyran-6-one | C10H16O5

(3aR,4S,7S,7aR)-7-Hydroxy-2,2,4,7-tetramethyltetrahydro-6H-[1,3]dioxolo[4,5-c]pyran-6-one

  • Molecular FormulaC10H16O5
  • Average mass216.231 Da
  • Monoisotopic mass216.099777 Da
  • ChemSpider ID30656955

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(3aR,4S,7S,7aR)-7-Hydroxy-2,2,4,7-tetramethyltetrahydro-6H-[1,3]dioxolo[4,5-c]pyran-6-on [German] [ACD/IUPAC Name]
(3aR,4S,7S,7aR)-7-Hydroxy-2,2,4,7-tetramethyltetrahydro-6H-[1,3]dioxolo[4,5-c]pyran-6-one [ACD/IUPAC Name]
(3aR,4S,7S,7aR)-7-Hydroxy-2,2,4,7-tétraméthyltétrahydro-6H-[1,3]dioxolo[4,5-c]pyran-6-one [French] [ACD/IUPAC 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: 348.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 68.6±6.0 kJ/mol
Flash Point: 135.7±21.4 °C
Index of Refraction: 1.465
Molar Refractivity: 50.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.05
ACD/LogD (pH 5.5): 0.64
ACD/BCF (pH 5.5): 1.81
ACD/KOC (pH 5.5): 53.24
ACD/LogD (pH 7.4): 0.64
ACD/BCF (pH 7.4): 1.81
ACD/KOC (pH 7.4): 53.24
Polar Surface Area: 65 Å2
Polarizability: 20.2±0.5 10-24cm3
Surface Tension: 32.9±3.0 dyne/cm
Molar Volume: 184.1±3.0 cm3

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