ChemSpider 2D Image | (3a'S,4R,7a'S)-2,2,2',2'-Tetramethyltetrahydrospiro[1,3-dioxolane-4,6'-[1,3]dioxolo[4,5-c]pyran]-7'-ol (non-preferred name) | C12H20O6

(3a'S,4R,7a'S)-2,2,2',2'-Tetramethyltetrahydrospiro[1,3-dioxolane-4,6'-[1,3]dioxolo[4,5-c]pyran]-7'-ol (non-preferred name)

  • Molecular FormulaC12H20O6
  • Average mass260.284 Da
  • Monoisotopic mass260.125977 Da
  • ChemSpider ID64872668

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

(3a'S,4R,7a'S)-2,2,2',2'-Tetramethyltetrahydrospiro[1,3-dioxolane-4,6'-[1,3]dioxolo[4,5-c]pyran]-7'-ol (non-preferred name) [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 379.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 72.5±6.0 kJ/mol
Flash Point: 183.0±27.9 °C
Index of Refraction: 1.522
Molar Refractivity: 61.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.08
ACD/LogD (pH 5.5): 2.37
ACD/BCF (pH 5.5): 36.94
ACD/KOC (pH 5.5): 460.95
ACD/LogD (pH 7.4): 2.37
ACD/BCF (pH 7.4): 36.94
ACD/KOC (pH 7.4): 460.95
Polar Surface Area: 66 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 44.9±5.0 dyne/cm
Molar Volume: 202.3±5.0 cm3

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