ChemSpider 2D Image | D-glucosyl 6-hydroxyindole-3-carboxylate | C15H17NO8

D-glucosyl 6-hydroxyindole-3-carboxylate

  • Molecular FormulaC15H17NO8
  • Average mass339.297 Da
  • Monoisotopic mass339.095428 Da
  • ChemSpider ID28532792

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

1-O-[(6-Hydroxy-1H-indol-3-yl)carbonyl]-D-glucopyranose [German] [ACD/IUPAC Name]
1-O-[(6-Hydroxy-1H-indol-3-yl)carbonyl]-D-glucopyranose [ACD/IUPAC Name]
1-O-[(6-Hydroxy-1H-indol-3-yl)carbonyl]-D-glucopyranose [French] [ACD/IUPAC Name]
D-Glucopyranose, 1-O-[(6-hydroxy-1H-indol-3-yl)carbonyl]- [ACD/Index Name]
D-glucosyl 6-hydroxyindole-3-carboxylate
1-(6-hydroxyindol-3-ylcarbonyl)-D-glucose
1-O-[(6-hydroxy-1H-indol-3-yl)carbonyl]-D-glucopyranose; 3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 6-hydroxy-1H-indole-3-carboxylate
6-OH-I3CO2Glc
  • Miscellaneous

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

Density: 1.7±0.1 g/cm3
Boiling Point: 688.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.1±3.0 kJ/mol
Flash Point: 370.5±31.5 °C
Index of Refraction: 1.736
Molar Refractivity: 79.8±0.4 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 1.20
ACD/LogD (pH 5.5): -0.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 19.43
ACD/LogD (pH 7.4): -0.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 19.36
Polar Surface Area: 152 Å2
Polarizability: 31.6±0.5 10-24cm3
Surface Tension: 107.6±5.0 dyne/cm
Molar Volume: 198.6±5.0 cm3

Click to predict properties on the Chemicalize site


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