ChemSpider 2D Image | Ethyl 4-chloro-1-(m-tolyl)-1H-pyrazolo[3,4-b]pyridine-5-carboxylate | C16H14ClN3O2

Ethyl 4-chloro-1-(m-tolyl)-1H-pyrazolo[3,4-b]pyridine-5-carboxylate

  • Molecular FormulaC16H14ClN3O2
  • Average mass315.754 Da
  • Monoisotopic mass315.077454 Da
  • ChemSpider ID21379490

More details:

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

1H-Pyrazolo[3,4-b]pyridine-5-carboxylic acid, 4-chloro-1-(3-methylphenyl)-, ethyl ester [ACD/Index Name]
4-Chloro-1-(3-méthylphényl)-1H-pyrazolo[3,4-b]pyridine-5-carboxylate d'éthyle [French] [ACD/IUPAC Name]
951624-03-6 [RN]
Ethyl 4-chloro-1-(3-methylphenyl)-1H-pyrazolo[3,4-b]pyridine-5-carboxylate [ACD/IUPAC Name]
Ethyl 4-chloro-1-(m-tolyl)-1H-pyrazolo[3,4-b]pyridine-5-carboxylate
Ethyl-4-chlor-1-(3-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-5-carboxylat [German] [ACD/IUPAC Name]
ethyl 4-chloro-1-(3-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxylate
ethyl 4-chloro-1-m-tolyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate
MFCD09788600

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 395.0±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.5±3.0 kJ/mol
    Flash Point: 192.7±27.9 °C
    Index of Refraction: 1.641
    Molar Refractivity: 85.2±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.14
    ACD/LogD (pH 5.5): 3.98
    ACD/BCF (pH 5.5): 623.08
    ACD/KOC (pH 5.5): 3482.84
    ACD/LogD (pH 7.4): 3.98
    ACD/BCF (pH 7.4): 623.10
    ACD/KOC (pH 7.4): 3482.95
    Polar Surface Area: 57 Å2
    Polarizability: 33.8±0.5 10-24cm3
    Surface Tension: 47.5±7.0 dyne/cm
    Molar Volume: 236.2±7.0 cm3

    Click to predict properties on the Chemicalize site


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