Found 894 results

Search term: MF = 'C_{11}H_{9}F_{2}N_{3}O_{2}'
ChemSpider 2D Image | Methyl 5-amino-1-(2,4-difluorophenyl)-1H-pyrazole-4-carboxylate | C11H9F2N3O2

Methyl 5-amino-1-(2,4-difluorophenyl)-1H-pyrazole-4-carboxylate

  • Molecular FormulaC11H9F2N3O2
  • Average mass253.205 Da
  • Monoisotopic mass253.066284 Da
  • ChemSpider ID29809174

More details:

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

1264049-61-7 [RN]
1H-Pyrazole-4-carboxylic acid, 5-amino-1-(2,4-difluorophenyl)-, methyl ester [ACD/Index Name]
5-Amino-1-(2,4-difluorophényl)-1H-pyrazole-4-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 5-amino-1-(2,4-difluorophenyl)-1H-pyrazole-4-carboxylate [ACD/IUPAC Name]
Methyl-5-amino-1-(2,4-difluorphenyl)-1H-pyrazol-4-carboxylat [German] [ACD/IUPAC Name]
atoms 18 bonds 19
methyl 5-amino-1-(2,4-difluorophenyl)pyrazole-4-carboxylate
MFCD18433832

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 363.4±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.9±3.0 kJ/mol
    Flash Point: 173.6±27.9 °C
    Index of Refraction: 1.593
    Molar Refractivity: 58.9±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.52
    ACD/LogD (pH 5.5): 2.75
    ACD/BCF (pH 5.5): 72.50
    ACD/KOC (pH 5.5): 746.84
    ACD/LogD (pH 7.4): 2.75
    ACD/BCF (pH 7.4): 72.50
    ACD/KOC (pH 7.4): 746.84
    Polar Surface Area: 70 Å2
    Polarizability: 23.3±0.5 10-24cm3
    Surface Tension: 44.3±7.0 dyne/cm
    Molar Volume: 173.7±7.0 cm3

    Click to predict properties on the Chemicalize site


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