ChemSpider 2D Image | 4-[5-(4-Methoxyphenyl)-3'-(4-methylphenyl)-1'-phenyl-4,5-dihydro-1H,1'H-3,4'-bipyrazol-1-yl]-4-oxobutanoic acid | C30H28N4O4

4-[5-(4-Methoxyphenyl)-3'-(4-methylphenyl)-1'-phenyl-4,5-dihydro-1H,1'H-3,4'-bipyrazol-1-yl]-4-oxobutanoic acid

  • Molecular FormulaC30H28N4O4
  • Average mass508.568 Da
  • Monoisotopic mass508.211060 Da
  • ChemSpider ID2742506

More details:

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

[3,4'-Bi-1H-pyrazole]-1-butanoic acid, 4,5-dihydro-5-(4-methoxyphenyl)-3'-(4-methylphenyl)-γ-oxo-1'-phenyl- [ACD/Index Name]
4-[5-(4-Methoxyphenyl)-3'-(4-methylphenyl)-1'-phenyl-4,5-dihydro-1H,1'H-3,4'-bipyrazol-1-yl]-4-oxobutanoic acid [ACD/IUPAC Name]
4-[5-(4-Methoxyphenyl)-3'-(4-methylphenyl)-1'-phenyl-4,5-dihydro-1H,1'H-3,4'-bipyrazol-1-yl]-4-oxobutansäure [German] [ACD/IUPAC Name]
Acide 4-[5-(4-méthoxyphényl)-3'-(4-méthylphényl)-1'-phényl-4,5-dihydro-1H,1'H-3,4'-bipyrazol-1-yl]-4-oxobutanoïque [French] [ACD/IUPAC Name]
4-(5-(4-methoxyphenyl)-1'-phenyl-3'-(p-tolyl)-4,5-dihydro-1H,1'H-[3,4'-bipyrazol]-1-yl)-4-oxobutanoic acid
4-[3-(4-methoxyphenyl)-5-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid
955890-64-9 [RN]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 729.7±70.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.5 mmHg at 25°C
    Enthalpy of Vaporization: 111.8±3.0 kJ/mol
    Flash Point: 395.1±35.7 °C
    Index of Refraction: 1.649
    Molar Refractivity: 145.7±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 1
    ACD/LogP: 3.90
    ACD/LogD (pH 5.5): 3.65
    ACD/BCF (pH 5.5): 233.21
    ACD/KOC (pH 5.5): 1059.63
    ACD/LogD (pH 7.4): 1.87
    ACD/BCF (pH 7.4): 3.80
    ACD/KOC (pH 7.4): 17.26
    Polar Surface Area: 97 Å2
    Polarizability: 57.7±0.5 10-24cm3
    Surface Tension: 50.8±7.0 dyne/cm
    Molar Volume: 399.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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