ChemSpider 2D Image | (4xi)-L-erythro-Hex-2-ulosonic acid | C6H10O7

(4ξ)-L-erythro-Hex-2-ulosonic acid

  • Molecular FormulaC6H10O7
  • Average mass194.139 Da
  • Monoisotopic mass194.042648 Da
  • ChemSpider ID65791559
  • defined stereocentres - 2 of 3 defined stereocentres


More details:






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

(4ξ)-L-erythro-Hex-2-ulosonic acid [ACD/IUPAC Name]
Acide (4ξ)-L-érythro-hex-2-ulosonique [French] [ACD/IUPAC Name]
L-erythro-2-Hexulosonic acid, (4ξ)- [ACD/Index Name]
2-Keto-L-gulonic acid

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.8±0.1 g/cm3
Boiling Point: 550.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.4 mmHg at 25°C
Enthalpy of Vaporization: 95.5±6.0 kJ/mol
Flash Point: 300.9±26.6 °C
Index of Refraction: 1.593
Molar Refractivity: 37.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -2.82
ACD/LogD (pH 5.5): -5.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 135 Å2
Polarizability: 14.8±0.5 10-24cm3
Surface Tension: 108.8±3.0 dyne/cm
Molar Volume: 110.5±3.0 cm3

Click to predict properties on the Chemicalize site






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