ChemSpider 2D Image | 6-[1-Phenyl(2-~2~H_1_)ethyl]-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione | C15H11DN2O2

6-[1-Phenyl(2-2H1)ethyl]-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione

  • Molecular FormulaC15H11DN2O2
  • Average mass253.274 Da
  • Monoisotopic mass253.096161 Da
  • ChemSpider ID8809990

  • Non-standard isotope - Non-standard isotope

More details:

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

5H-Pyrrolo[3,4-b]pyridine-5,7(6H)-dione, 6-(1-phenylethyl-2-d)- [ACD/Index Name]
6-[1-Phenyl(2-2H1)ethyl]-5H-pyrrolo[3,4-b]pyridin-5,7(6H)-dion [German] [ACD/IUPAC Name]
6-[1-Phenyl(2-2H1)ethyl]-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione [ACD/IUPAC Name]
6-[1-Phényl(2-2H1)éthyl]-5H-pyrrolo[3,4-b]pyridine-5,7(6H)-dione [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 414.7±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.8±3.0 kJ/mol
Flash Point: 204.6±24.0 °C
Index of Refraction: 1.647
Molar Refractivity: 69.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.19
ACD/LogD (pH 5.5): 2.20
ACD/BCF (pH 5.5): 27.67
ACD/KOC (pH 5.5): 374.78
ACD/LogD (pH 7.4): 2.20
ACD/BCF (pH 7.4): 27.67
ACD/KOC (pH 7.4): 374.78
Polar Surface Area: 50 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 61.8±3.0 dyne/cm
Molar Volume: 191.4±3.0 cm3

Click to predict properties on the Chemicalize site


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