ChemSpider 2D Image | 3-Hydroxy-4-[(4-methoxyphenoxy)acetyl]phenyl 2,3,4,6-tetra-O-acetyl-alpha-D-glycero-hexopyranoside | C29H32O14

3-Hydroxy-4-[(4-methoxyphenoxy)acetyl]phenyl 2,3,4,6-tetra-O-acetyl-α-D-glycero-hexopyranoside

  • Molecular FormulaC29H32O14
  • Average mass604.556 Da
  • Monoisotopic mass604.179199 Da
  • ChemSpider ID17463017

  • defined stereocentres - 2 of 5 defined stereocentres

More details:

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

2,3,4,6-Tétra-O-acétyl-α-D-glycéro-hexopyranoside de 3-hydroxy-4-[2-(4-méthoxyphénoxy)acétyl]phényle [French] [ACD/IUPAC Name]
3-Hydroxy-4-[(4-methoxyphenoxy)acetyl]phenyl 2,3,4,6-tetra-O-acetyl-α-D-glycero-hexopyranoside [ACD/IUPAC Name]
3-Hydroxy-4-[(4-methoxyphenoxy)acetyl]phenyl-2,3,4,6-tetra-O-acetyl-α-D-glycero-hexopyranosid [German] [ACD/IUPAC Name]
Ethanone, 1-[2-hydroxy-4-[(2,3,4,6-tetra-O-acetyl-α-D-glycero-hexopyranosyl)oxy]phenyl]-2-(4-methoxyphenoxy)- [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: 708.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.3±3.0 kJ/mol
Flash Point: 225.2±26.4 °C
Index of Refraction: 1.571
Molar Refractivity: 144.1±0.4 cm3
#H bond acceptors: 14
#H bond donors: 1
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 4.46
ACD/LogD (pH 5.5): 3.90
ACD/BCF (pH 5.5): 541.63
ACD/KOC (pH 5.5): 3124.57
ACD/LogD (pH 7.4): 3.39
ACD/BCF (pH 7.4): 166.74
ACD/KOC (pH 7.4): 961.88
Polar Surface Area: 179 Å2
Polarizability: 57.1±0.5 10-24cm3
Surface Tension: 59.7±5.0 dyne/cm
Molar Volume: 438.6±5.0 cm3

Click to predict properties on the Chemicalize site


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