ChemSpider 2D Image | 5-Amino-1-(3-methoxyphenyl)-1H-pyrazole-4-carbonitrile | C11H10N4O

5-Amino-1-(3-methoxyphenyl)-1H-pyrazole-4-carbonitrile

  • Molecular FormulaC11H10N4O
  • Average mass214.223 Da
  • Monoisotopic mass214.085464 Da
  • ChemSpider ID25469354

More details:

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

1H-Pyrazole-4-carbonitrile, 5-amino-1-(3-methoxyphenyl)- [ACD/Index Name]
5-Amino-1-(3-methoxyphenyl)-1H-pyrazol-4-carbonitril [German] [ACD/IUPAC Name]
5-Amino-1-(3-methoxyphenyl)-1H-pyrazole-4-carbonitrile [ACD/IUPAC Name]
5-Amino-1-(3-méthoxyphényl)-1H-pyrazole-4-carbonitrile [French] [ACD/IUPAC Name]
650628-66-3 [RN]
5-Amino-1-(3-methoxy-phenyl)-1H-pyrazole-4-carbonitrile
5-amino-1-(3-methoxyphenyl)pyrazole-4-carbonitrile
5-amino-4-cyano-1-(3'-methoxyphenyl)pyrazole
AGN-PC-0NT2B7
AKOS022258721
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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: 443.3±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.1±3.0 kJ/mol
    Flash Point: 221.9±27.3 °C
    Index of Refraction: 1.638
    Molar Refractivity: 60.2±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.07
    ACD/LogD (pH 5.5): 1.44
    ACD/BCF (pH 5.5): 7.26
    ACD/KOC (pH 5.5): 143.91
    ACD/LogD (pH 7.4): 1.44
    ACD/BCF (pH 7.4): 7.26
    ACD/KOC (pH 7.4): 143.91
    Polar Surface Area: 77 Å2
    Polarizability: 23.9±0.5 10-24cm3
    Surface Tension: 51.9±7.0 dyne/cm
    Molar Volume: 167.4±7.0 cm3

    Click to predict properties on the Chemicalize site


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