ChemSpider 2D Image | 4-Benzoyl-3-hydroxyphenyl 2,3,4,6-tetra-O-acetylhexopyranoside | C27H28O12

4-Benzoyl-3-hydroxyphenyl 2,3,4,6-tetra-O-acetylhexopyranoside

  • Molecular FormulaC27H28O12
  • Average mass544.504 Da
  • Monoisotopic mass544.158081 Da
  • ChemSpider ID4313722

More details:

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

2,3,4,6-Tétra-O-acétylhexopyranoside de 4-benzoyl-3-hydroxyphényle [French] [ACD/IUPAC Name]
4-Benzoyl-3-hydroxyphenyl 2,3,4,6-tetra-O-acetylhexopyranoside [ACD/IUPAC Name]
4-Benzoyl-3-hydroxyphenyl-2,3,4,6-tetra-O-acetylhexopyranosid [German] [ACD/IUPAC Name]
Methanone, [2-hydroxy-4-[(2,3,4,6-tetra-O-acetylhexopyranosyl)oxy]phenyl]phenyl- [ACD/Index Name]
{3,4,5-triacetyloxy-6-[3-hydroxy-4-(phenylcarbonyl)phenoxy]-2H-3,4,5,6-tetrahydropyran-2-yl}methyl acetate

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

Density: 1.4±0.1 g/cm3
Boiling Point: 631.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.7±3.0 kJ/mol
Flash Point: 203.3±25.0 °C
Index of Refraction: 1.579
Molar Refractivity: 131.3±0.4 cm3
#H bond acceptors: 12
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 4.43
ACD/LogD (pH 5.5): 3.98
ACD/BCF (pH 5.5): 618.66
ACD/KOC (pH 5.5): 3453.24
ACD/LogD (pH 7.4): 3.69
ACD/BCF (pH 7.4): 318.17
ACD/KOC (pH 7.4): 1775.94
Polar Surface Area: 161 Å2
Polarizability: 52.1±0.5 10-24cm3
Surface Tension: 60.1±5.0 dyne/cm
Molar Volume: 395.2±5.0 cm3

Click to predict properties on the Chemicalize site


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