ChemSpider 2D Image | [(4S,5R)-2,2-Dimethyl(5-~2~H_1_)-1,3-dioxolan-4-yl]methanol | C6H11DO3

[(4S,5R)-2,2-Dimethyl(5-2H1)-1,3-dioxolan-4-yl]methanol

  • Molecular FormulaC6H11DO3
  • Average mass133.164 Da
  • Monoisotopic mass133.084915 Da
  • ChemSpider ID8416336

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

[(4S,5R)-2,2-Dimethyl(5-2H1)-1,3-dioxolan-4-yl]methanol [ACD/IUPAC Name]
[(4S,5R)-2,2-Dimethyl(5-2H1)-1,3-dioxolan-4-yl]methanol [German] [ACD/IUPAC Name]
[(4S,5R)-2,2-Diméthyl(5-2H1)-1,3-dioxolan-4-yl]méthanol [French] [ACD/IUPAC Name]
1,3-Dioxolane-5-d-4-methanol, 2,2-dimethyl-, (4S,5R)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 188.5±0.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.7 mmHg at 25°C
Enthalpy of Vaporization: 49.4±6.0 kJ/mol
Flash Point: 80.0±0.0 °C
Index of Refraction: 1.424
Molar Refractivity: 32.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.06
ACD/LogD (pH 5.5): 0.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 33.31
ACD/LogD (pH 7.4): 0.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 33.31
Polar Surface Area: 39 Å2
Polarizability: 12.9±0.5 10-24cm3
Surface Tension: 36.2±3.0 dyne/cm
Molar Volume: 127.8±3.0 cm3

Click to predict properties on the Chemicalize site


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