ChemSpider 2D Image | (2Z)-2-(beta-D-Glucopyranosyloxy)-3-phenylacrylic acid | C15H18O8

(2Z)-2-(β-D-Glucopyranosyloxy)-3-phenylacrylic acid

  • Molecular FormulaC15H18O8
  • Average mass326.299 Da
  • Monoisotopic mass326.100159 Da
  • ChemSpider ID65321179
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 5 of 5 defined stereocentres


More details:






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

(2Z)-2-(β-D-Glucopyranosyloxy)-3-phenylacrylic acid [ACD/IUPAC Name]
(2Z)-2-(β-D-Glucopyranosyloxy)-3-phenylacrylsäure [German] [ACD/IUPAC Name]
2-Propenoic acid, 2-(β-D-glucopyranosyloxy)-3-phenyl-, (2Z)- [ACD/Index Name]
Acide (2Z)-2-(β-D-glucopyranosyloxy)-3-phénylacrylique [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 621.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.9±3.0 kJ/mol
Flash Point: 232.8±25.0 °C
Index of Refraction: 1.650
Molar Refractivity: 77.2±0.4 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 1.94
ACD/LogD (pH 5.5): -2.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 137 Å2
Polarizability: 30.6±0.5 10-24cm3
Surface Tension: 83.1±5.0 dyne/cm
Molar Volume: 211.8±5.0 cm3

Click to predict properties on the Chemicalize site






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