ChemSpider 2D Image | 3-{1H-pyrrolo[2,3-b]pyridin-5-yl}pyridine | C12H9N3

3-{1H-pyrrolo[2,3-b]pyridin-5-yl}pyridine

  • Molecular FormulaC12H9N3
  • Average mass195.220 Da
  • Monoisotopic mass195.079651 Da
  • ChemSpider ID26000538

More details:

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

1H-Pyrrolo[2,3-b]pyridine, 5-(3-pyridinyl)- [ACD/Index Name]
3-{1H-pyrrolo[2,3-b]pyridin-5-yl}pyridine
5-(3-Pyridinyl)-1H-pyrrolo[2,3-b]pyridin [German] [ACD/IUPAC Name]
5-(3-Pyridinyl)-1H-pyrrolo[2,3-b]pyridine [ACD/IUPAC Name]
5-(3-Pyridinyl)-1H-pyrrolo[2,3-b]pyridine [French] [ACD/IUPAC Name]
918511-92-9 [RN]
[918511-92-9] [RN]
5-(pyridin-3-yl)-1H-pyrrolo[2,3-b]pyridine
5-pyridin-3-yl-1H-pyrrolo[1,3-b]pyridine
5-Pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 433.5±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.3±3.0 kJ/mol
    Flash Point: 209.6±17.5 °C
    Index of Refraction: 1.699
    Molar Refractivity: 59.3±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.15
    ACD/LogD (pH 5.5): 1.86
    ACD/BCF (pH 5.5): 14.93
    ACD/KOC (pH 5.5): 237.01
    ACD/LogD (pH 7.4): 1.88
    ACD/BCF (pH 7.4): 15.82
    ACD/KOC (pH 7.4): 251.10
    Polar Surface Area: 42 Å2
    Polarizability: 23.5±0.5 10-24cm3
    Surface Tension: 62.8±3.0 dyne/cm
    Molar Volume: 153.6±3.0 cm3

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