ChemSpider 2D Image | 2-(Hydroxymethyl)phenyl 6-O-palmitoyl-beta-D-glucopyranoside | C29H48O8

2-(Hydroxymethyl)phenyl 6-O-palmitoyl-β-D-glucopyranoside

  • Molecular FormulaC29H48O8
  • Average mass524.687 Da
  • Monoisotopic mass524.334900 Da
  • ChemSpider ID8090435

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2-(Hydroxymethyl)phenyl 6-O-palmitoyl-β-D-glucopyranoside [ACD/IUPAC Name]
2-(Hydroxymethyl)phenyl-6-O-palmitoyl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
6-O-Palmitoyl-β-D-glucopyranoside de 2-(hydroxyméthyl)phényle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, 2-(hydroxymethyl)phenyl 6-O-(1-oxohexadecyl)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 661.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.2±3.0 kJ/mol
Flash Point: 206.6±25.0 °C
Index of Refraction: 1.532
Molar Refractivity: 142.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 2
ACD/LogP: 7.44
ACD/LogD (pH 5.5): 6.89
ACD/BCF (pH 5.5): 101175.97
ACD/KOC (pH 5.5): 133110.78
ACD/LogD (pH 7.4): 6.89
ACD/BCF (pH 7.4): 101174.86
ACD/KOC (pH 7.4): 133109.31
Polar Surface Area: 126 Å2
Polarizability: 56.6±0.5 10-24cm3
Surface Tension: 45.4±3.0 dyne/cm
Molar Volume: 460.4±3.0 cm3

Click to predict properties on the Chemicalize site


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