ChemSpider 2D Image | 6-Phenyl-2-(1-piperazinyl)nicotinonitrile | C16H16N4

6-Phenyl-2-(1-piperazinyl)nicotinonitrile

  • Molecular FormulaC16H16N4
  • Average mass264.325 Da
  • Monoisotopic mass264.137512 Da
  • ChemSpider ID25076858

More details:

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

1198475-33-0 [RN]
3-Pyridinecarbonitrile, 6-phenyl-2-(1-piperazinyl)- [ACD/Index Name]
6-Phenyl-2-(1-piperazinyl)-3-pyridinecarbonitrile
6-Phenyl-2-(1-piperazinyl)nicotinonitril [German] [ACD/IUPAC Name]
6-Phenyl-2-(1-piperazinyl)nicotinonitrile [ACD/IUPAC Name]
6-Phényl-2-(1-pipérazinyl)nicotinonitrile [French] [ACD/IUPAC Name]
6-phenyl-2-(piperazin-1-yl)pyridine-3-carbonitrile
6-phenyl-2-(piperazin-1-yl)nicotinonitrile
6-phenyl-2-piperazin-1-ylpyridine-3-carbonitrile
6-Phenyl-2-piperazinonicotinonitrile
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 502.1±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 77.1±3.0 kJ/mol
    Flash Point: 257.5±30.1 °C
    Index of Refraction: 1.650
    Molar Refractivity: 77.8±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.76
    ACD/LogD (pH 5.5): -0.18
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.37
    ACD/LogD (pH 7.4): 1.53
    ACD/BCF (pH 7.4): 5.46
    ACD/KOC (pH 7.4): 69.11
    Polar Surface Area: 52 Å2
    Polarizability: 30.9±0.5 10-24cm3
    Surface Tension: 64.3±5.0 dyne/cm
    Molar Volume: 213.4±5.0 cm3

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