Found 96 results

Search term: MF = 'C_{16}H_{19}NO_{8}'
ChemSpider 2D Image | 3-(2-Hydroxyethyl)-1H-indol-5-yl beta-D-glucopyranosiduronic acid | C16H19NO8

3-(2-Hydroxyethyl)-1H-indol-5-yl β-D-glucopyranosiduronic acid

  • Molecular FormulaC16H19NO8
  • Average mass353.324 Da
  • Monoisotopic mass353.111053 Da
  • ChemSpider ID57530367

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

3-(2-Hydroxyethyl)-1H-indol-5-yl β-D-glucopyranosiduronic acid [ACD/IUPAC Name]
3-(2-Hydroxyethyl)-1H-indol-5-yl-β-D-glucopyranosiduronsäure [German] [ACD/IUPAC Name]
Acide β-D-glucopyranosiduronique de 3-(2-hydroxyéthyl)-1H-indol-5-yle [French] [ACD/IUPAC Name]
β-D-Glucopyranosiduronic acid, 3-(2-hydroxyethyl)-1H-indol-5-yl [ACD/Index Name]
27939-38-4 [RN]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 728.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 111.6±3.0 kJ/mol
Flash Point: 394.3±32.9 °C
Index of Refraction: 1.732
Molar Refractivity: 85.2±0.3 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -1.77
ACD/LogD (pH 5.5): -3.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 152 Å2
Polarizability: 33.8±0.5 10-24cm3
Surface Tension: 103.9±3.0 dyne/cm
Molar Volume: 213.0±3.0 cm3

Click to predict properties on the Chemicalize site


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