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Search term: QCSQBVBCECKTPQ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | Methyl 2,3,6-tris-O-[(benzyloxy)carbonyl]-alpha-D-mannopyranoside | C31H32O12

Methyl 2,3,6-tris-O-[(benzyloxy)carbonyl]-α-D-mannopyranoside

  • Molecular FormulaC31H32O12
  • Average mass596.579 Da
  • Monoisotopic mass596.189392 Da
  • ChemSpider ID9105279

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2,3,6-Tris-O-[(benzyloxy)carbonyl]-α-D-mannopyranoside de méthyle [French] [ACD/IUPAC Name]
Methyl 2,3,6-tris-O-[(benzyloxy)carbonyl]-α-D-mannopyranoside [ACD/IUPAC Name]
Methyl-2,3,6-tris-O-[(benzyloxy)carbonyl]-α-D-mannopyranosid [German] [ACD/IUPAC Name]
α-D-Mannopyranoside, methyl 2,3,6-tris-O-[(phenylmethoxy)carbonyl]- [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: 768.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 117.4±3.0 kJ/mol
Flash Point: 246.9±26.4 °C
Index of Refraction: 1.597
Molar Refractivity: 150.0±0.4 cm3
#H bond acceptors: 12
#H bond donors: 1
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 3
ACD/LogP: 6.08
ACD/LogD (pH 5.5): 5.14
ACD/BCF (pH 5.5): 4743.93
ACD/KOC (pH 5.5): 14892.67
ACD/LogD (pH 7.4): 5.14
ACD/BCF (pH 7.4): 4743.84
ACD/KOC (pH 7.4): 14892.38
Polar Surface Area: 145 Å2
Polarizability: 59.5±0.5 10-24cm3
Surface Tension: 60.4±5.0 dyne/cm
Molar Volume: 440.5±5.0 cm3

Click to predict properties on the Chemicalize site


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