ChemSpider 2D Image | 2,3,4-Tri-O-acetyl-N-(4-biphenylylacetyl)-beta-D-glucopyranuronosylamine | C26H27NO10

2,3,4-Tri-O-acetyl-N-(4-biphenylylacetyl)-β-D-glucopyranuronosylamine

  • Molecular FormulaC26H27NO10
  • Average mass513.493 Da
  • Monoisotopic mass513.163513 Da
  • ChemSpider ID8340144

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2,3,4-Tri-O-acetyl-N-(4-biphenylylacetyl)-β-D-glucopyranuronosylamin [German] [ACD/IUPAC Name]
2,3,4-Tri-O-acetyl-N-(4-biphenylylacetyl)-β-D-glucopyranuronosylamine [ACD/IUPAC Name]
2,3,4-Tri-O-acétyl-N-[2-(4-biphénylyl)acétyl]-β-D-glucopyranuronosylamine [French] [ACD/IUPAC Name]
β-D-Glucopyranuronosylamine, N-(2-[1,1'-biphenyl]-4-ylacetyl)-, 2,3,4-triacetate [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: 712.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 109.4±3.0 kJ/mol
Flash Point: 384.8±32.9 °C
Index of Refraction: 1.592
Molar Refractivity: 126.9±0.4 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 3.86
ACD/LogD (pH 5.5): -0.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 155 Å2
Polarizability: 50.3±0.5 10-24cm3
Surface Tension: 61.3±5.0 dyne/cm
Molar Volume: 375.1±5.0 cm3

Click to predict properties on the Chemicalize site


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