ChemSpider 2D Image | 8-Hydroxy-3-[(2S)-2-hydroxypropyl]-1-oxo-1H-isochromen-6-yl alpha-D-ribofuranoside | C17H20O9

8-Hydroxy-3-[(2S)-2-hydroxypropyl]-1-oxo-1H-isochromen-6-yl α-D-ribofuranoside

  • Molecular FormulaC17H20O9
  • Average mass368.335 Da
  • Monoisotopic mass368.110718 Da
  • ChemSpider ID34981942

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

1H-2-Benzopyran-1-one, 8-hydroxy-3-[(2S)-2-hydroxypropyl]-6-(α-D-ribofuranosyloxy)- [ACD/Index Name]
8-Hydroxy-3-[(2S)-2-hydroxypropyl]-1-oxo-1H-isochromen-6-yl α-D-ribofuranoside [ACD/IUPAC Name]
8-Hydroxy-3-[(2S)-2-hydroxypropyl]-1-oxo-1H-isochromen-6-yl-α-D-ribofuranosid [German] [ACD/IUPAC Name]
α-D-Ribofuranoside de 8-hydroxy-3-[(2S)-2-hydroxypropyl]-1-oxo-1H-isochromén-6-yle [French] [ACD/IUPAC Name]
daldiniside C

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

Density: 1.5±0.1 g/cm3
Boiling Point: 710.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 109.0±3.0 kJ/mol
Flash Point: 260.7±26.4 °C
Index of Refraction: 1.649
Molar Refractivity: 86.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 0.64
ACD/LogD (pH 5.5): 0.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 28.27
ACD/LogD (pH 7.4): -0.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.78
Polar Surface Area: 146 Å2
Polarizability: 34.3±0.5 10-24cm3
Surface Tension: 77.2±3.0 dyne/cm
Molar Volume: 237.8±3.0 cm3

Click to predict properties on the Chemicalize site


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