ChemSpider 2D Image | 1-Benzyl-4-bromo-5-methyl-1H-pyrazole-3-carboxamide | C12H12BrN3O

1-Benzyl-4-bromo-5-methyl-1H-pyrazole-3-carboxamide

  • Molecular FormulaC12H12BrN3O
  • Average mass294.147 Da
  • Monoisotopic mass293.016357 Da
  • ChemSpider ID29358835

More details:

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

1262414-75-4 [RN]
1-Benzyl-4-brom-5-methyl-1H-pyrazol-3-carboxamid [German] [ACD/IUPAC Name]
1-Benzyl-4-bromo-5-methyl-1H-pyrazole-3-carboxamide [ACD/IUPAC Name]
1-Benzyl-4-bromo-5-méthyl-1H-pyrazole-3-carboxamide [French] [ACD/IUPAC Name]
1H-Pyrazole-3-carboxamide, 4-bromo-5-methyl-1-(phenylmethyl)- [ACD/Index Name]
1-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide
1-BENZYL-4-BROMO-5-METHYLPYRAZOLE-3-CARBOXAMIDE
2-Morpholino-2,3-dihydro-1H-indene-2-carbonitrile
MFCD19443340

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

CCRIS 4693 [DBID]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 425.0±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.0±3.0 kJ/mol
    Flash Point: 210.9±28.7 °C
    Index of Refraction: 1.657
    Molar Refractivity: 69.9±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.90
    ACD/LogD (pH 5.5): 1.79
    ACD/BCF (pH 5.5): 13.50
    ACD/KOC (pH 5.5): 224.28
    ACD/LogD (pH 7.4): 1.79
    ACD/BCF (pH 7.4): 13.50
    ACD/KOC (pH 7.4): 224.28
    Polar Surface Area: 61 Å2
    Polarizability: 27.7±0.5 10-24cm3
    Surface Tension: 52.2±7.0 dyne/cm
    Molar Volume: 190.1±7.0 cm3

    Click to predict properties on the Chemicalize site


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