ChemSpider 2D Image | (2Z)-3-[2-(beta-D-Glucopyranosyloxy)-4-methoxyphenyl]acrylic acid | C16H20O9

(2Z)-3-[2-(β-D-Glucopyranosyloxy)-4-methoxyphenyl]acrylic acid

  • Molecular FormulaC16H20O9
  • Average mass356.325 Da
  • Monoisotopic mass356.110718 Da
  • ChemSpider ID22913845

  • 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)-3-[2-(β-D-Glucopyranosyloxy)-4-methoxyphenyl]acrylic acid [ACD/IUPAC Name]
(2Z)-3-[2-(β-D-Glucopyranosyloxy)-4-methoxyphenyl]acrylsäure [German] [ACD/IUPAC Name]
2-Propenoic acid, 3-[2-(β-D-glucopyranosyloxy)-4-methoxyphenyl]-, (2Z)- [ACD/Index Name]
Acide (2Z)-3-[2-(β-D-glucopyranosyloxy)-4-méthoxyphényl]acrylique [French] [ACD/IUPAC Name]
150892-86-7 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 658.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.8±3.0 kJ/mol
Flash Point: 241.9±25.0 °C
Index of Refraction: 1.650
Molar Refractivity: 86.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -0.30
ACD/LogD (pH 5.5): -1.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 146 Å2
Polarizability: 34.1±0.5 10-24cm3
Surface Tension: 68.2±3.0 dyne/cm
Molar Volume: 236.1±3.0 cm3

Click to predict properties on the Chemicalize site


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