ChemSpider 2D Image | (3R,3aR,6S,6aS)-3,5,6-Trihydroxytetrahydrofuro[3,2-b]furan-2(3H)-one (non-preferred name) | C6H8O6

(3R,3aR,6S,6aS)-3,5,6-Trihydroxytetrahydrofuro[3,2-b]furan-2(3H)-one (non-preferred name)

  • Molecular FormulaC6H8O6
  • Average mass176.124 Da
  • Monoisotopic mass176.032089 Da
  • ChemSpider ID61591933

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

(3R,3aR,6S,6aS)-3,5,6-Trihydroxytetrahydrofuro[3,2-b]furan-2(3H)-on (non-preferred name) [German] [ACD/IUPAC Name]
(3R,3aR,6S,6aS)-3,5,6-Trihydroxytetrahydrofuro[3,2-b]furan-2(3H)-one (non-preferred name) [ACD/IUPAC Name]
(3R,3aR,6S,6aS)-3,5,6-Trihydroxytétrahydrofuro[3,2-b]furan-2(3H)-one (non-preferred name) [French] [ACD/IUPAC Name]
2089586-82-1 [RN]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 488.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 87.0±6.0 kJ/mol
Flash Point: 214.2±22.2 °C
Index of Refraction: 1.652
Molar Refractivity: 33.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -1.55
ACD/LogD (pH 5.5): -1.92
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.16
ACD/LogD (pH 7.4): -1.92
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.16
Polar Surface Area: 96 Å2
Polarizability: 13.4±0.5 10-24cm3
Surface Tension: 107.6±3.0 dyne/cm
Molar Volume: 92.5±3.0 cm3

Click to predict properties on the Chemicalize site


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