ChemSpider 2D Image | [(3aS,3bR,7aS,8aS)-2,2,5,5-Tetramethyltetrahydro-8aH-[1,3]dioxolo[4,5]furo[3,2-d][1,3]dioxin-8a-yl]methanol | C12H20O6

[(3aS,3bR,7aS,8aS)-2,2,5,5-Tetramethyltetrahydro-8aH-[1,3]dioxolo[4,5]furo[3,2-d][1,3]dioxin-8a-yl]methanol

  • Molecular FormulaC12H20O6
  • Average mass260.284 Da
  • Monoisotopic mass260.125977 Da
  • ChemSpider ID21436149

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

[(3aS,3bR,7aS,8aS)-2,2,5,5-Tetramethyltetrahydro-8aH-[1,3]dioxolo[4,5]furo[3,2-d][1,3]dioxin-8a-yl]methanol [ACD/IUPAC Name]
[(3aS,3bR,7aS,8aS)-2,2,5,5-Tetramethyltetrahydro-8aH-[1,3]dioxolo[4,5]furo[3,2-d][1,3]dioxin-8a-yl]methanol [German] [ACD/IUPAC Name]
[(3aS,3bR,7aS,8aS)-2,2,5,5-Tétraméthyltétrahydro-8aH-[1,3]dioxolo[4,5]furo[3,2-d][1,3]dioxin-8a-yl]méthanol [French] [ACD/IUPAC Name]
17682-70-1 [RN]
D-4080
Diacetone L-sorbose

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

Density: 1.2±0.1 g/cm3
Boiling Point: 329.3±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 66.3±6.0 kJ/mol
Flash Point: 153.0±26.5 °C
Index of Refraction: 1.468
Molar Refractivity: 61.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.31
ACD/LogD (pH 5.5): 2.34
ACD/BCF (pH 5.5): 35.10
ACD/KOC (pH 5.5): 444.40
ACD/LogD (pH 7.4): 2.34
ACD/BCF (pH 7.4): 35.10
ACD/KOC (pH 7.4): 444.40
Polar Surface Area: 66 Å2
Polarizability: 24.3±0.5 10-24cm3
Surface Tension: 45.1±3.0 dyne/cm
Molar Volume: 220.3±3.0 cm3

Click to predict properties on the Chemicalize site


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