ChemSpider 2D Image | 2,6-Anhydro-1,3,4-tri-O-benzyl-5-deoxy-D-glycero-hex-5-enitol | C27H28O4

2,6-Anhydro-1,3,4-tri-O-benzyl-5-deoxy-D-glycero-hex-5-enitol

  • Molecular FormulaC27H28O4
  • Average mass416.509 Da
  • Monoisotopic mass416.198761 Da
  • ChemSpider ID28411135

  • defined stereocentres - 1 of 3 defined stereocentres

More details:

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

2,6-Anhydro-1,3,4-tri-O-benzyl-5-deoxy-D-glycero-hex-5-enitol [ACD/IUPAC Name]
2,6-Anhydro-1,3,4-tri-O-benzyl-5-desoxy-D-glycero-hex-5-enitol [German] [ACD/IUPAC Name]
2,6-Anhydro-1,3,4-tri-O-benzyl-5-désoxy-D-glycéro-hex-5-énitol [French] [ACD/IUPAC Name]
D-glycero-Hex-5-enitol, 2,6-anhydro-5-deoxy-1,3,4-tris-O-(phenylmethyl)- [ACD/Index Name]
3,4,6-Tri-O-benzyl-D-galactal
80040-79-5 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 544.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.3±3.0 kJ/mol
Flash Point: 129.7±36.9 °C
Index of Refraction: 1.603
Molar Refractivity: 122.6±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 5.36
ACD/LogD (pH 5.5): 5.45
ACD/BCF (pH 5.5): 8108.69
ACD/KOC (pH 5.5): 21858.34
ACD/LogD (pH 7.4): 5.45
ACD/BCF (pH 7.4): 8108.69
ACD/KOC (pH 7.4): 21858.34
Polar Surface Area: 37 Å2
Polarizability: 48.6±0.5 10-24cm3
Surface Tension: 49.2±5.0 dyne/cm
Molar Volume: 356.9±5.0 cm3

Click to predict properties on the Chemicalize site


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