ChemSpider 2D Image | Dihydromelilotoside | C15H20O8

Dihydromelilotoside

  • Molecular FormulaC15H20O8
  • Average mass328.315 Da
  • Monoisotopic mass328.115814 Da
  • ChemSpider ID24678791

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

24696-05-7 [RN]
3-[2-(β-D-Glucopyranosyloxy)phenyl]propanoic acid [ACD/IUPAC Name]
3-[2-(β-D-Glucopyranosyloxy)phenyl]propansäure [German] [ACD/IUPAC Name]
Acide 3-[2-(β-D-glucopyranosyloxy)phényl]propanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, 2-(β-D-glucopyranosyloxy)- [ACD/Index Name]
Dihydromelilotoside

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

Density: 1.5±0.1 g/cm3
Boiling Point: 593.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.0±3.0 kJ/mol
Flash Point: 220.4±23.6 °C
Index of Refraction: 1.623
Molar Refractivity: 77.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -1.05
ACD/LogD (pH 5.5): -1.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.16
ACD/LogD (pH 7.4): -3.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 137 Å2
Polarizability: 30.8±0.5 10-24cm3
Surface Tension: 69.0±3.0 dyne/cm
Molar Volume: 220.5±3.0 cm3

Click to predict properties on the Chemicalize site


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