ChemSpider 2D Image | 6-Chloro-1H-indol-3-yl beta-D-glucopyranoside | C14H16ClNO6

6-Chloro-1H-indol-3-yl β-D-glucopyranoside

  • Molecular FormulaC14H16ClNO6
  • Average mass329.733 Da
  • Monoisotopic mass329.066620 Da
  • ChemSpider ID21435891

  • defined stereocentres - 3 of 5 defined stereocentres

More details:

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

6-Chlor-1H-indol-3-yl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
6-Chloro-1H-indol-3-yl β-D-glucopyranoside [ACD/IUPAC Name]
β-D-Glucopyranoside de 6-chloro-1H-indol-3-yle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, 6-chloro-1H-indol-3-yl [ACD/Index Name]
159954-28-6 [RN]
6-Chloro-3-indolyl b-D-glucopyranoside
6-Chloro-3-indolyl b-D-glucopyranoside|Rose glucoside
C-5020
C-5073
Rose glucoside

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

Density: 1.6±0.1 g/cm3
Boiling Point: 630.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 98.0±3.0 kJ/mol
Flash Point: 335.0±31.5 °C
Index of Refraction: 1.717
Molar Refractivity: 79.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -0.15
ACD/LogD (pH 5.5): 0.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 34.14
ACD/LogD (pH 7.4): 0.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 34.14
Polar Surface Area: 115 Å2
Polarizability: 31.4±0.5 10-24cm3
Surface Tension: 77.7±3.0 dyne/cm
Molar Volume: 200.9±3.0 cm3

Click to predict properties on the Chemicalize site


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