ChemSpider 2D Image | 1-Allyl-1H-benzimidazol-2-yl 2,3,4,6-tetra-O-acetyl-1-thio-beta-D-mannopyranoside | C24H28N2O9S

1-Allyl-1H-benzimidazol-2-yl 2,3,4,6-tetra-O-acetyl-1-thio-β-D-mannopyranoside

  • Molecular FormulaC24H28N2O9S
  • Average mass520.552 Da
  • Monoisotopic mass520.151550 Da
  • ChemSpider ID62447898

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

1-Allyl-1H-benzimidazol-2-yl 2,3,4,6-tetra-O-acetyl-1-thio-β-D-mannopyranoside [ACD/IUPAC Name]
1-Allyl-1H-benzimidazol-2-yl-2,3,4,6-tetra-O-acetyl-1-thio-β-D-mannopyranosid [German] [ACD/IUPAC Name]
2,3,4,6-Tétra-O-acétyl-1-thio-β-D-mannopyranoside de 1-allyl-1H-benzimidazol-2-yle [French] [ACD/IUPAC Name]
β-D-Mannopyranoside, 1-(2-propen-1-yl)-1H-benzimidazol-2-yl 1-thio-, 2,3,4,6-tetraacetate [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 619.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.8±3.0 kJ/mol
Flash Point: 328.4±34.3 °C
Index of Refraction: 1.598
Molar Refractivity: 129.8±0.5 cm3
#H bond acceptors: 11
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: 5.06
ACD/LogD (pH 5.5): 3.94
ACD/BCF (pH 5.5): 574.73
ACD/KOC (pH 5.5): 3247.57
ACD/LogD (pH 7.4): 3.96
ACD/BCF (pH 7.4): 599.47
ACD/KOC (pH 7.4): 3387.35
Polar Surface Area: 158 Å2
Polarizability: 51.4±0.5 10-24cm3
Surface Tension: 48.1±7.0 dyne/cm
Molar Volume: 380.1±7.0 cm3

Click to predict properties on the Chemicalize site


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