ChemSpider 2D Image | 6-[(2,3,4,6-Tetra-O-acetyl-alpha-D-mannopyranosyl)oxy]-2,4-hexadiyn-1-yl 2,3,4,6-tetra-O-acetyl-alpha-D-mannopyranoside | C34H42O20

6-[(2,3,4,6-Tetra-O-acetyl-α-D-mannopyranosyl)oxy]-2,4-hexadiyn-1-yl 2,3,4,6-tetra-O-acetyl-α-D-mannopyranoside

  • Molecular FormulaC34H42O20
  • Average mass770.685 Da
  • Monoisotopic mass770.226929 Da
  • ChemSpider ID9529655

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

2,3,4,6-Tétra-O-acétyl-α-D-mannopyranoside de 6-[(2,3,4,6-tétra-O-acétyl-α-D-mannopyranosyl)oxy]-2,4-hexadiyn-1-yle [French] [ACD/IUPAC Name]
6-[(2,3,4,6-Tetra-O-acetyl-α-D-mannopyranosyl)oxy]-2,4-hexadiin-1-yl-2,3,4,6-tetra-O-acetyl-α-D-mannopyranosid [German] [ACD/IUPAC Name]
6-[(2,3,4,6-Tetra-O-acetyl-α-D-mannopyranosyl)oxy]-2,4-hexadiyn-1-yl 2,3,4,6-tetra-O-acetyl-α-D-mannopyranoside [ACD/IUPAC Name]
α-D-Mannopyranoside, 6-[(2,3,4,6-tetra-O-acetyl-α-D-mannopyranosyl)oxy]-2,4-hexadiyn-1-yl, 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: 749.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.3±3.0 kJ/mol
Flash Point: 301.8±32.9 °C
Index of Refraction: 1.526
Molar Refractivity: 173.0±0.4 cm3
#H bond acceptors: 20
#H bond donors: 0
#Freely Rotating Bonds: 25
#Rule of 5 Violations: 3
ACD/LogP: 5.37
ACD/LogD (pH 5.5): 3.29
ACD/BCF (pH 5.5): 184.65
ACD/KOC (pH 5.5): 1458.37
ACD/LogD (pH 7.4): 3.29
ACD/BCF (pH 7.4): 184.65
ACD/KOC (pH 7.4): 1458.37
Polar Surface Area: 247 Å2
Polarizability: 68.6±0.5 10-24cm3
Surface Tension: 57.6±5.0 dyne/cm
Molar Volume: 563.8±5.0 cm3

Click to predict properties on the Chemicalize site


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