ChemSpider 2D Image | 3-(Carboxymethyl)-1-hexopyranosyl-1H-indole | C16H19NO7

3-(Carboxymethyl)-1-hexopyranosyl-1H-indole

  • Molecular FormulaC16H19NO7
  • Average mass337.325 Da
  • Monoisotopic mass337.116150 Da
  • ChemSpider ID78443953

More details:

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

1H-Indole, 3-(carboxymethyl)-1-hexopyranosyl- [ACD/Index Name]
3-(Carboxymethyl)-1-hexopyranosyl-1H-indol [German] [ACD/IUPAC Name]
3-(Carboxymethyl)-1-hexopyranosyl-1H-indole [ACD/IUPAC Name]
3-(Carboxyméthyl)-1-hexopyranosyl-1H-indole [French] [ACD/IUPAC Name]
1-(1-b-Glucopyranosyl)-1H-indole-3-acetic acid

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

Density: 1.6±0.1 g/cm3
Boiling Point: 677.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.5±3.0 kJ/mol
Flash Point: 363.6±31.5 °C
Index of Refraction: 1.696
Molar Refractivity: 79.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 0.87
ACD/LogD (pH 5.5): -1.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.95
ACD/LogD (pH 7.4): -2.87
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 132 Å2
Polarizability: 31.4±0.5 10-24cm3
Surface Tension: 70.2±7.0 dyne/cm
Molar Volume: 205.6±7.0 cm3

Click to predict properties on the Chemicalize site


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