ChemSpider 2D Image | [(3,5-Dimethyl-1H-pyrazol-4-yl)(phenyl)methyl]urea | C13H16N4O

[(3,5-Dimethyl-1H-pyrazol-4-yl)(phenyl)methyl]urea

  • Molecular FormulaC13H16N4O
  • Average mass244.292 Da
  • Monoisotopic mass244.132416 Da
  • ChemSpider ID21436634

More details:

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

[(3,5-Dimethyl-1H-pyrazol-4-yl)(phenyl)methyl]urea
1-[(3,5-Dimethyl-1H-pyrazol-4-yl)(phenyl)methyl]harnstoff [German] [ACD/IUPAC Name]
1-[(3,5-Dimethyl-1H-pyrazol-4-yl)(phenyl)methyl]urea [ACD/IUPAC Name]
1-[(3,5-Diméthyl-1H-pyrazol-4-yl)(phényl)méthyl]urée [French] [ACD/IUPAC Name]
1187557-14-7 [RN]
Urea, N-[(3,5-dimethyl-1H-pyrazol-4-yl)phenylmethyl]- [ACD/Index Name]
[(3,5-dimethyl-1H-pyrazol-4-yl)-phenylmethyl]urea
[(3,5-Dimethyl-1H-pyrazol-4-yl)phenylmethyl]-urea
[(3,5-Dimethyl-1H-pyrazol-4-yl)-phenyl-methyl]-urea
1-((3,5-dimethyl-1H-pyrazol-4-yl)(phenyl)methyl)urea
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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: 480.1±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 74.5±3.0 kJ/mol
    Flash Point: 244.2±28.7 °C
    Index of Refraction: 1.613
    Molar Refractivity: 69.5±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 4
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.66
    ACD/LogD (pH 5.5): 1.76
    ACD/BCF (pH 5.5): 12.74
    ACD/KOC (pH 5.5): 214.07
    ACD/LogD (pH 7.4): 1.77
    ACD/BCF (pH 7.4): 12.95
    ACD/KOC (pH 7.4): 217.64
    Polar Surface Area: 84 Å2
    Polarizability: 27.6±0.5 10-24cm3
    Surface Tension: 56.5±3.0 dyne/cm
    Molar Volume: 199.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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