ChemSpider 2D Image | (2E)-3-[4-(beta-D-Glucopyranosyloxy)phenyl]acrylate | C15H17O8

(2E)-3-[4-(β-D-Glucopyranosyloxy)phenyl]acrylate

  • Molecular FormulaC15H17O8
  • Average mass325.291 Da
  • Monoisotopic mass325.092896 Da
  • ChemSpider ID21865468

  • Charge - Charge

    defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(2E)-3-[4-(β-D-Glucopyranosyloxy)phenyl]acrylat [German] [ACD/IUPAC Name]
(2E)-3-[4-(β-D-Glucopyranosyloxy)phenyl]acrylate [ACD/IUPAC Name]
(2E)-3-[4-(β-D-Glucopyranosyloxy)phényl]acrylate [French] [ACD/IUPAC Name]
2-Propenoic acid, 3-[4-(β-D-glucopyranosyloxy)phenyl]-, ion(1-), (2E)- [ACD/Index Name]
3-[4-(β-D-glucopyranosyloxy)phenyl]acrylate
3-[4-(β-D-glucopyranosyloxy)phenyl]prop-2-enoate
4-O-β-D-glucosyl-4-coumarate
4-O-β-D-Glucosyl-4-hydroxycinnamate
  • Miscellaneous

    • Chemical Class:

      A monocarboxylic acid anion that is the is conjugate base of 4-O-beta-D-glucosyl-4-coumaric acid. ChEBI CHEBI:47893

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

Density:
Boiling Point: 631.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 98.1±3.0 kJ/mol
Flash Point: 236.4±25.0 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -0.47
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): -3.68
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 140 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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