ChemSpider 2D Image | (2,4,5,6,7-~2~H_5_)-6H-Indol-3-yl acetate | C10H4D5NO2

(2,4,5,6,7-2H5)-6H-Indol-3-yl acetate

  • Molecular FormulaC10H4D5NO2
  • Average mass180.215 Da
  • Monoisotopic mass180.094711 Da
  • ChemSpider ID111126836

  • Non-standard isotope - Non-standard isotope

More details:

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

(2,4,5,6,7-2H5)-6H-Indol-3-yl acetate [ACD/IUPAC Name]
(2,4,5,6,7-2H5)-6H-Indol-3-yl-acetat [German] [ACD/IUPAC Name]
6H-Indol-2,4,5,6,7-d5-3-ol, acetate (ester) [ACD/Index Name]
Acétate de (2,4,5,6,7-2H5)-6H-indol-3-yle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 418.5±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.2±3.0 kJ/mol
Flash Point: 231.8±21.2 °C
Index of Refraction: 1.590
Molar Refractivity: 48.6±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.76
ACD/LogD (pH 5.5): 0.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.70
ACD/LogD (pH 7.4): 1.36
ACD/BCF (pH 7.4): 5.77
ACD/KOC (pH 7.4): 109.35
Polar Surface Area: 39 Å2
Polarizability: 19.3±0.5 10-24cm3
Surface Tension: 42.5±7.0 dyne/cm
Molar Volume: 144.1±7.0 cm3

Click to predict properties on the Chemicalize site


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