ChemSpider 2D Image | (3aS,4S,6R,7R,7aS,3a'S,4'S,6'R,7'R,7a'S)-6,6'-(1,2-Ethanediyl)bis(4-methoxy-2,2-dimethyltetrahydro-4H-[1,3]dioxolo[4,5-c]pyran-7-ol) | C20H34O10

(3aS,4S,6R,7R,7aS,3a'S,4'S,6'R,7'R,7a'S)-6,6'-(1,2-Ethanediyl)bis(4-methoxy-2,2-dimethyltetrahydro-4H-[1,3]dioxolo[4,5-c]pyran-7-ol)

  • Molecular FormulaC20H34O10
  • Average mass434.478 Da
  • Monoisotopic mass434.215210 Da
  • ChemSpider ID30653818

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(3aS,4S,6R,7R,7aS,3a'S,4'S,6'R,7'R,7a'S)-6,6'-(1,2-Ethandiyl)bis(4-methoxy-2,2-dimethyltetrahydro-4H-[1,3]dioxolo[4,5-c]pyran-7-ol) [German] [ACD/IUPAC Name]
(3aS,4S,6R,7R,7aS,3a'S,4'S,6'R,7'R,7a'S)-6,6'-(1,2-Ethanediyl)bis(4-methoxy-2,2-dimethyltetrahydro-4H-[1,3]dioxolo[4,5-c]pyran-7-ol) [ACD/IUPAC Name]
(3aS,4S,6R,7R,7aS,3a'S,4'S,6'R,7'R,7a'S)-6,6'-(1,2-Éthanediyl)bis(4-méthoxy-2,2-diméthyltétrahydro-4H-[1,3]dioxolo[4,5-c]pyran-7-ol) [French] [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: 575.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 99.0±6.0 kJ/mol
Flash Point: 301.8±30.1 °C
Index of Refraction: 1.533
Molar Refractivity: 103.3±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 3.21
ACD/LogD (pH 5.5): 2.09
ACD/BCF (pH 5.5): 23.00
ACD/KOC (pH 5.5): 328.30
ACD/LogD (pH 7.4): 2.09
ACD/BCF (pH 7.4): 23.00
ACD/KOC (pH 7.4): 328.30
Polar Surface Area: 114 Å2
Polarizability: 40.9±0.5 10-24cm3
Surface Tension: 49.5±5.0 dyne/cm
Molar Volume: 332.5±5.0 cm3

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