ChemSpider 2D Image | 4-Ethynylpyrimidine | C6H4N2

4-Ethynylpyrimidine

  • Molecular FormulaC6H4N2
  • Average mass104.109 Da
  • Monoisotopic mass104.037445 Da
  • ChemSpider ID13454816

More details:

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

1196146-58-3 [RN]
4-Ethinylpyrimidin [German] [ACD/IUPAC Name]
4-Ethynylpyrimidine [ACD/IUPAC Name]
4-Éthynylpyrimidine [French] [ACD/IUPAC Name]
Pyrimidine, 4-ethynyl- [ACD/Index Name]
4-ETHYNYLPYRIMIDINE|4-ETHYNYLPYRIMIDINE
4-Etynyl-Pyrimidine
MFCD13189781

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 184.5±13.0 °C at 760 mmHg
    Vapour Pressure: 1.0±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 40.4±3.0 kJ/mol
    Flash Point: 68.5±6.2 °C
    Index of Refraction: 1.544
    Molar Refractivity: 29.4±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: -0.15
    ACD/LogD (pH 5.5): 0.10
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 27.00
    ACD/LogD (pH 7.4): 0.10
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 27.00
    Polar Surface Area: 26 Å2
    Polarizability: 11.7±0.5 10-24cm3
    Surface Tension: 55.4±5.0 dyne/cm
    Molar Volume: 93.2±5.0 cm3

    Click to predict properties on the Chemicalize site


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