ChemSpider 2D Image | (3aS,4S,5aR,9aR,9bS)-4-Methoxy-2,2,8,8-tetramethylhexahydro[1,3]dioxolo[4,5]pyrano[3,2-d][1,3]dioxine | C13H22O6

(3aS,4S,5aR,9aR,9bS)-4-Methoxy-2,2,8,8-tetramethylhexahydro[1,3]dioxolo[4,5]pyrano[3,2-d][1,3]dioxine

  • Molecular FormulaC13H22O6
  • Average mass274.310 Da
  • Monoisotopic mass274.141632 Da
  • ChemSpider ID17207385

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(3aS,4S,5aR,9aR,9bS)-4-Methoxy-2,2,8,8-tetramethylhexahydro[1,3]dioxolo[4,5]pyrano[3,2-d][1,3]dioxin [German] [ACD/IUPAC Name]
(3aS,4S,5aR,9aR,9bS)-4-Methoxy-2,2,8,8-tetramethylhexahydro[1,3]dioxolo[4,5]pyrano[3,2-d][1,3]dioxine [ACD/IUPAC Name]
(3aS,4S,5aR,9aR,9bS)-4-Méthoxy-2,2,8,8-tétraméthylhexahydro[1,3]dioxolo[4,5]pyrano[3,2-d][1,3]dioxine [French] [ACD/IUPAC Name]
50705-56-1 [RN]
Methyl 2,3:4,6-di-O-isopropylidene-D-mannopyranoside
METHYL-2,3,4,6-DI-OXO-ISOPROPYLIDENE-D-MANNOPYRANOSIDE
METHYL-2,3:4,6-DI-O-ISOPROPYLIDENE-D-MANNOPYRANOSIDE
Methyl-2,3;4,6-Di-O-isopropylidene-D-mannopyranoside

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

Density: 1.2±0.1 g/cm3
Boiling Point: 330.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.0±3.0 kJ/mol
Flash Point: 130.3±27.8 °C
Index of Refraction: 1.495
Molar Refractivity: 66.5±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.27
ACD/LogD (pH 5.5): 2.29
ACD/BCF (pH 5.5): 32.30
ACD/KOC (pH 5.5): 418.67
ACD/LogD (pH 7.4): 2.29
ACD/BCF (pH 7.4): 32.30
ACD/KOC (pH 7.4): 418.67
Polar Surface Area: 55 Å2
Polarizability: 26.3±0.5 10-24cm3
Surface Tension: 38.1±5.0 dyne/cm
Molar Volume: 228.1±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement