ChemSpider 2D Image | (2S,3R,4R,6R)-6-(Hydroxymethyl)dihydro-2H-pyran-2,3,4,5,5(6H)-pentol (non-preferred name) | C6H12O7

(2S,3R,4R,6R)-6-(Hydroxymethyl)dihydro-2H-pyran-2,3,4,5,5(6H)-pentol (non-preferred name)

  • Molecular FormulaC6H12O7
  • Average mass196.155 Da
  • Monoisotopic mass196.058304 Da
  • ChemSpider ID61688158

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2S,3R,4R,6R)-6-(Hydroxymethyl)dihydro-2H-pyran-2,3,4,5,5(6H)-pentol (non-preferred name) [German] [ACD/IUPAC Name]
(2S,3R,4R,6R)-6-(Hydroxymethyl)dihydro-2H-pyran-2,3,4,5,5(6H)-pentol (non-preferred name) [ACD/IUPAC Name]
(2S,3R,4R,6R)-6-(Hydroxyméthyl)dihydro-2H-pyrane-2,3,4,5,5(6H)-pentol (non-preferred name) [French] [ACD/IUPAC Name]
1932600-46-8 [RN]
glc
α-D-Glucose

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

Density: 2.0±0.1 g/cm3
Boiling Point: 444.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 81.0±6.0 kJ/mol
Flash Point: 222.5±28.7 °C
Index of Refraction: 1.708
Molar Refractivity: 38.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 6
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 0.52
ACD/LogD (pH 5.5): -2.52
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.02
ACD/LogD (pH 7.4): -2.52
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.02
Polar Surface Area: 131 Å2
Polarizability: 15.4±0.5 10-24cm3
Surface Tension: 112.6±3.0 dyne/cm
Molar Volume: 99.4±3.0 cm3

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