ChemSpider 2D Image | (3aR,5S,6aS)-5-[(4S)-2,2-Dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyldihydrofuro[2,3-d][1,3]dioxole-6,6(5H)-diol (non-preferred name) | C12H20O7

(3aR,5S,6aS)-5-[(4S)-2,2-Dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyldihydrofuro[2,3-d][1,3]dioxole-6,6(5H)-diol (non-preferred name)

  • Molecular FormulaC12H20O7
  • Average mass276.283 Da
  • Monoisotopic mass276.120911 Da
  • ChemSpider ID62480822

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(3aR,5S,6aS)-5-[(4S)-2,2-Dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyldihydrofuro[2,3-d][1,3]dioxol-6,6(5H)-diol (non-preferred name) [German] [ACD/IUPAC Name]
(3aR,5S,6aS)-5-[(4S)-2,2-Dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyldihydrofuro[2,3-d][1,3]dioxole-6,6(5H)-diol (non-preferred name) [ACD/IUPAC Name]
(3aR,5S,6aS)-5-[(4S)-2,2-Diméthyl-1,3-dioxolan-4-yl]-2,2-diméthyldihydrofuro[2,3-d][1,3]dioxole-6,6(5H)-diol (non-preferred name) [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: 434.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 79.7±6.0 kJ/mol
Flash Point: 216.4±28.7 °C
Index of Refraction: 1.510
Molar Refractivity: 62.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.42
ACD/LogD (pH 5.5): 1.77
ACD/BCF (pH 5.5): 12.94
ACD/KOC (pH 5.5): 217.59
ACD/LogD (pH 7.4): 1.77
ACD/BCF (pH 7.4): 12.94
ACD/KOC (pH 7.4): 217.55
Polar Surface Area: 87 Å2
Polarizability: 24.9±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 209.8±3.0 cm3

Click to predict properties on the Chemicalize site


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