ChemSpider 2D Image | (2S,3R,4R,5R)-2,3,4,5,7-Pentahydroxyheptanal | C7H14O6

(2S,3R,4R,5R)-2,3,4,5,7-Pentahydroxyheptanal

  • Molecular FormulaC7H14O6
  • Average mass194.182 Da
  • Monoisotopic mass194.079041 Da
  • ChemSpider ID75155879

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2S,3R,4R,5R)-2,3,4,5,7-Pentahydroxyheptanal [German] [ACD/IUPAC Name]
(2S,3R,4R,5R)-2,3,4,5,7-Pentahydroxyheptanal [ACD/IUPAC Name]
(2S,3R,4R,5R)-2,3,4,5,7-Pentahydroxyheptanal [French] [ACD/IUPAC Name]
D-altro-Heptose, 6-deoxy- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 515.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 90.6±6.0 kJ/mol
Flash Point: 279.6±26.6 °C
Index of Refraction: 1.560
Molar Refractivity: 42.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -2.97
ACD/LogD (pH 5.5): -2.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.62
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 118 Å2
Polarizability: 16.7±0.5 10-24cm3
Surface Tension: 82.2±3.0 dyne/cm
Molar Volume: 130.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement