ChemSpider 2D Image | 2,3,5-Tri-O-benzyl-1-O-(4-nitrobenzoyl)-alpha-L-xylofuranose | C33H31NO8

2,3,5-Tri-O-benzyl-1-O-(4-nitrobenzoyl)-α-L-xylofuranose

  • Molecular FormulaC33H31NO8
  • Average mass569.601 Da
  • Monoisotopic mass569.204956 Da
  • ChemSpider ID34018381

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

2,3,5-Tri-O-benzyl-1-O-(4-nitrobenzoyl)-α-L-xylofuranose [German] [ACD/IUPAC Name]
2,3,5-Tri-O-benzyl-1-O-(4-nitrobenzoyl)-α-L-xylofuranose [ACD/IUPAC Name]
2,3,5-Tri-O-benzyl-1-O-(4-nitrobenzoyl)-α-L-xylofuranose [French] [ACD/IUPAC Name]
α-L-Xylofuranose, 2,3,5-tris-O-(phenylmethyl)-, 4-nitrobenzoate [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: 706.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.3±3.0 kJ/mol
Flash Point: 246.8±34.9 °C
Index of Refraction: 1.631
Molar Refractivity: 155.3±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 8.36
ACD/LogD (pH 5.5): 7.10
ACD/BCF (pH 5.5): 145512.70
ACD/KOC (pH 5.5): 172656.00
ACD/LogD (pH 7.4): 7.10
ACD/BCF (pH 7.4): 145512.70
ACD/KOC (pH 7.4): 172656.00
Polar Surface Area: 109 Å2
Polarizability: 61.6±0.5 10-24cm3
Surface Tension: 59.7±5.0 dyne/cm
Molar Volume: 436.1±5.0 cm3

Click to predict properties on the Chemicalize site


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