ChemSpider 2D Image | beta-(1->6)-galactotriitol | C18H34O16

β-(1->6)-galactotriitol

  • Molecular FormulaC18H34O16
  • Average mass506.453 Da
  • Monoisotopic mass506.184692 Da
  • ChemSpider ID26332365

  • defined stereocentres - 14 of 14 defined stereocentres

More details:

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

D-Galactitol, O-β-D-galactopyranosyl-(1->6)-O-β-D-galactopyranosyl-(1->;6)- [ACD/Index Name]
β-(1->6)-galactotriitol
β-D-Galactopyranosyl-(1->6)-β-D-galactopyranosyl-(1->6)-D-galactitol [German] [ACD/IUPAC Name]
β-D-Galactopyranosyl-(1->6)-β-D-galactopyranosyl-(1->6)-D-galactitol [ACD/IUPAC Name]
β-D-Galactopyranosyl-(1->6)-β-D-galactopyranosyl-(1->6)-D-galactitol [French] [ACD/IUPAC Name]
missing
β-D-Gal-(1->6)-β-D-Gal-(1->6)-D-galactitol
β-D-galactosyl-(1->6)-β-D-galactosyl-(1->6)-D-galactitol
β-D-Galp-(1->6)-β-D-Galp-(1->6)-D-galactitol
  • Miscellaneous

    • Chemical Class:

      A glycoside composed of two <stereo>beta</stereo>-<stereo>D</stereo>-galactosyl residues and one galactitol unit all joined via (1<arrow>right</arrow>6)-linkages. ChEBI CHEBI:61769
      A glycoside composed of two beta-D-galactosyl residues and one galactitol unit all joined via (1->6)-linkages. ChEBI CHEBI:61769
      A glycoside composed of two beta-D-galactosyl residues and one galactitol unit all joined via (1right6)-linkages. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:61769

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

Density: 1.8±0.1 g/cm3
Boiling Point: 972.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 160.7±6.0 kJ/mol
Flash Point: 542.1±34.3 °C
Index of Refraction: 1.660
Molar Refractivity: 106.4±0.4 cm3
#H bond acceptors: 16
#H bond donors: 12
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: -5.64
ACD/LogD (pH 5.5): -5.61
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 280 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 117.7±5.0 dyne/cm
Molar Volume: 288.2±5.0 cm3

Click to predict properties on the Chemicalize site


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