ChemSpider 2D Image | 4-(beta-D-Galactopyranosyloxy)-3-methoxybenzoic acid | C14H18O9

4-(β-D-Galactopyranosyloxy)-3-methoxybenzoic acid

  • Molecular FormulaC14H18O9
  • Average mass330.287 Da
  • Monoisotopic mass330.095093 Da
  • ChemSpider ID128925749

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

4-(β-D-Galactopyranosyloxy)-3-methoxybenzoesäure [German] [ACD/IUPAC Name]
4-(β-D-Galactopyranosyloxy)-3-methoxybenzoic acid [ACD/IUPAC Name]
Acide 4-(β-D-galactopyranosyloxy)-3-méthoxybenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-(β-D-galactopyranosyloxy)-3-methoxy- [ACD/Index Name]
32142-31-7 [RN]
Vanillic Acid 4-β-D-glucopyranoside

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

Density: 1.5±0.1 g/cm3
Boiling Point: 597.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.6±3.0 kJ/mol
Flash Point: 224.1±23.6 °C
Index of Refraction: 1.628
Molar Refractivity: 75.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -0.91
ACD/LogD (pH 5.5): -2.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 146 Å2
Polarizability: 30.0±0.5 10-24cm3
Surface Tension: 69.9±3.0 dyne/cm
Molar Volume: 213.0±3.0 cm3

Click to predict properties on the Chemicalize site


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