Found 2 results

Search term: MF = 'C_{11}H_{9}D_{2}NO_{2}'
ChemSpider 2D Image | 3-(7H-Indol-3-yl)(2,2-~2~H_2_)propanoic acid | C11H9D2NO2

3-(7H-Indol-3-yl)(2,2-2H2)propanoic acid

  • Molecular FormulaC11H9D2NO2
  • Average mass191.223 Da
  • Monoisotopic mass191.091537 Da
  • ChemSpider ID111126879

  • Non-standard isotope - Non-standard isotope

More details:

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

3-(7H-Indol-3-yl)(2,2-2H2)propanoic acid [ACD/IUPAC Name]
3-(7H-Indol-3-yl)(2,2-2H2)propansäure [German] [ACD/IUPAC Name]
7H-Indole-3-propanoic-α,α-d2 acid [ACD/Index Name]
Acide 3-(7H-indol-3-yl)(2,2-2H2)propanoïque [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: 406.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 72.2±6.0 kJ/mol
Flash Point: 199.5±28.7 °C
Index of Refraction: 1.613
Molar Refractivity: 52.9±0.5 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.06
ACD/LogD (pH 5.5): -0.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 50 Å2
Polarizability: 21.0±0.5 10-24cm3
Surface Tension: 48.4±7.0 dyne/cm
Molar Volume: 151.9±7.0 cm3

Click to predict properties on the Chemicalize site


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