ChemSpider 2D Image | 3-O-beta-D-Gulopyranosyl-D-allonic acid | C12H22O12

3-O-β-D-Gulopyranosyl-D-allonic acid

  • Molecular FormulaC12H22O12
  • Average mass358.296 Da
  • Monoisotopic mass358.111115 Da
  • ChemSpider ID67037316

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

3-O-β-D-Gulopyranosyl-D-allonic acid [ACD/IUPAC Name]
3-O-β-D-Gulopyranosyl-D-allonsäure [German] [ACD/IUPAC Name]
Acide 3-O-β-D-gulopyranosyl-D-allonique [French] [ACD/IUPAC Name]
D-Allonic acid, 3-O-β-D-gulopyranosyl- [ACD/Index Name]
Lactobions??ure

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

Density: 1.8±0.1 g/cm3
Boiling Point: 864.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 142.8±6.0 kJ/mol
Flash Point: 319.1±27.8 °C
Index of Refraction: 1.648
Molar Refractivity: 72.8±0.4 cm3
#H bond acceptors: 12
#H bond donors: 9
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -3.30
ACD/LogD (pH 5.5): -5.82
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 218 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 119.9±5.0 dyne/cm
Molar Volume: 200.0±5.0 cm3

Click to predict properties on the Chemicalize site


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