ChemSpider 2D Image | 2-[(Acetoxyacetyl)amino]-1,3,4,6-tetra-O-acetyl-2-deoxy-alpha-D-mannopyranose | C18H25NO12

2-[(Acetoxyacetyl)amino]-1,3,4,6-tetra-O-acetyl-2-deoxy-α-D-mannopyranose

  • Molecular FormulaC18H25NO12
  • Average mass447.391 Da
  • Monoisotopic mass447.137665 Da
  • ChemSpider ID25056314

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2-[(2-Acétoxyacétyl)amino]-1,3,4,6-tétra-O-acétyl-2-désoxy-α-D-mannopyranose [French] [ACD/IUPAC Name]
2-[(Acetoxyacetyl)amino]-1,3,4,6-tetra-O-acetyl-2-deoxy-α-D-mannopyranose [ACD/IUPAC Name]
2-[(Acetoxyacetyl)amino]-1,3,4,6-tetra-O-acetyl-2-desoxy-α-D-mannopyranose [German] [ACD/IUPAC Name]
α-D-Mannopyranose, 2-[[2-(acetyloxy)acetyl]amino]-2-deoxy-, 1,3,4,6-tetraacetate [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 581.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.0±3.0 kJ/mol
Flash Point: 305.7±30.1 °C
Index of Refraction: 1.498
Molar Refractivity: 98.0±0.4 cm3
#H bond acceptors: 13
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 0.55
ACD/LogD (pH 5.5): 0.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 31.58
ACD/LogD (pH 7.4): 0.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 31.58
Polar Surface Area: 170 Å2
Polarizability: 38.9±0.5 10-24cm3
Surface Tension: 50.7±5.0 dyne/cm
Molar Volume: 334.6±5.0 cm3

Click to predict properties on the Chemicalize site


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