ChemSpider 2D Image | 1-O-[(2E)-3-(4-Hydroxy-3,5-dimethoxyphenyl)-2-propenoyl]hexopyranose | C17H22O10

1-O-[(2E)-3-(4-Hydroxy-3,5-dimethoxyphenyl)-2-propenoyl]hexopyranose

  • Molecular FormulaC17H22O10
  • Average mass386.351 Da
  • Monoisotopic mass386.121307 Da
  • ChemSpider ID24785464
  • Double-bond stereo - Double-bond stereo


More details:






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

1-O-[(2E)-3-(4-Hydroxy-3,5-dimethoxyphenyl)-2-propenoyl]hexopyranose [ACD/IUPAC Name]
1-O-[(2E)-3-(4-Hydroxy-3,5-dimethoxyphenyl)-2-propenoyl]hexopyranose [German] [ACD/IUPAC Name]
1-O-[(2E)-3-(4-Hydroxy-3,5-diméthoxyphényl)-2-propenoyl]hexopyranose [French] [ACD/IUPAC Name]
Hexopyranose, 1-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxo-2-propen-1-yl]- [ACD/Index Name]
1-O-sinapoyl &β;-D-glucoside
1-O-sinapoyl-β-D-glucose

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

Density: 1.5±0.1 g/cm3
Boiling Point: 630.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 98.0±3.0 kJ/mol
Flash Point: 226.6±25.0 °C
Index of Refraction: 1.625
Molar Refractivity: 90.2±0.4 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 0.44
ACD/LogD (pH 5.5): -0.42
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.05
ACD/LogD (pH 7.4): -0.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 13.98
Polar Surface Area: 155 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 78.3±5.0 dyne/cm
Molar Volume: 255.0±5.0 cm3

Click to predict properties on the Chemicalize site






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