ChemSpider 2D Image | 3,4-O-[(1R)-1-Carboxyethylidene]-beta-D-erythro-hexopyranose | C9H14O8

3,4-O-[(1R)-1-Carboxyethylidene]-β-D-erythro-hexopyranose

  • Molecular FormulaC9H14O8
  • Average mass250.203 Da
  • Monoisotopic mass250.068863 Da
  • ChemSpider ID95601273

  • defined stereocentres - 4 of 6 defined stereocentres

More details:

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

3,4-O-[(1R)-1-Carboxyethyliden]-β-D-erythro-hexopyranose [German] [ACD/IUPAC Name]
3,4-O-[(1R)-1-Carboxyethylidene]-β-D-erythro-hexopyranose [ACD/IUPAC Name]
3,4-O-[(1R)-1-Carboxyéthylidène]-β-D-érythro-hexopyranose [French] [ACD/IUPAC Name]
β-D-erythro-Hexopyranose, 3,4-O-[(1R)-1-carboxyethylidene]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 542.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 94.3±6.0 kJ/mol
Flash Point: 219.0±23.6 °C
Index of Refraction: 1.559
Molar Refractivity: 50.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.61
ACD/LogD (pH 5.5): -3.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 126 Å2
Polarizability: 20.1±0.5 10-24cm3
Surface Tension: 68.5±3.0 dyne/cm
Molar Volume: 157.0±3.0 cm3

Click to predict properties on the Chemicalize site


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