ChemSpider 2D Image | NONIOSIDE B | C26H46O17

NONIOSIDE B

  • Molecular FormulaC26H46O17
  • Average mass630.633 Da
  • Monoisotopic mass630.273499 Da
  • ChemSpider ID23283175

  • defined stereocentres - 15 of 15 defined stereocentres

More details:

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

255904-23-5 [RN]
NONIOSIDE B
β-D-Glucopyranose, O-β-D-glucopyranosyl-(1->2)-O-[β-D-glucopyranosyl-(1->6)]-1-O-(1-oxooctyl)- [ACD/Index Name]
β-D-Glucopyranosyl-(1->2)-[β-D-glucopyranosyl-(1->6)]-1-O-octanoyl-β-D-glucopyranose [ACD/IUPAC Name]
β-D-Glucopyranosyl-(1->2)-[β-D-glucopyranosyl-(1->6)]-1-O-octanoyl-β-D-glucopyranose [German] [ACD/IUPAC Name]
β-D-Glucopyranosyl-(1->2)-[β-D-glucopyranosyl-(1->6)]-1-O-octanoyl-β-D-glucopyranose [French] [ACD/IUPAC Name]
2,6-di-O-(β-D-glucopyranosyl)-1-O-octanoyl-β-D-glucopyranose

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

506E4PD858 [DBID]
UNII:506E4PD858 [DBID]
UNII-506E4PD858 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 865.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 142.9±6.0 kJ/mol
Flash Point: 278.0±27.8 °C
Index of Refraction: 1.604
Molar Refractivity: 141.9±0.4 cm3
#H bond acceptors: 17
#H bond donors: 10
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: -2.49
ACD/LogD (pH 5.5): -2.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.36
ACD/LogD (pH 7.4): -2.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.36
Polar Surface Area: 275 Å2
Polarizability: 56.3±0.5 10-24cm3
Surface Tension: 84.1±5.0 dyne/cm
Molar Volume: 412.7±5.0 cm3

Click to predict properties on the Chemicalize site


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