ChemSpider 2D Image | 3-(1H-Pyrrol-2-yl)-1H-pyrazole | C7H7N3

3-(1H-Pyrrol-2-yl)-1H-pyrazole

  • Molecular FormulaC7H7N3
  • Average mass133.151 Da
  • Monoisotopic mass133.063995 Da
  • ChemSpider ID23488001

More details:

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

1H-Pyrazole, 3-(1H-pyrrol-2-yl)- [ACD/Index Name]
3-(1H-Pyrrol-2-yl)-1H-pyrazol [German] [ACD/IUPAC Name]
3-(1H-Pyrrol-2-yl)-1H-pyrazole [ACD/IUPAC Name]
3-(1H-Pyrrol-2-yl)-1H-pyrazole [French] [ACD/IUPAC Name]
1019010-39-9 [RN]
5-azolylpyrazole
MFCD06808816 [MDL number]
pyrazolylpyrrole
VS-09981
ZINC36047668

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 427.2±20.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 65.6±3.0 kJ/mol
    Flash Point: 220.6±14.7 °C
    Index of Refraction: 1.643
    Molar Refractivity: 37.8±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.01
    ACD/LogD (pH 5.5): 1.39
    ACD/BCF (pH 5.5): 6.65
    ACD/KOC (pH 5.5): 134.77
    ACD/LogD (pH 7.4): 1.39
    ACD/BCF (pH 7.4): 6.70
    ACD/KOC (pH 7.4): 135.80
    Polar Surface Area: 44 Å2
    Polarizability: 15.0±0.5 10-24cm3
    Surface Tension: 62.4±3.0 dyne/cm
    Molar Volume: 104.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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