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Search term: MF = 'C_{9}H_{12}BrN_{3}O'

ChemSpider 2D Image | 5-Bromo-N,N-diethyl-2-pyrimidinecarboxamide | C9H12BrN3O

5-Bromo-N,N-diethyl-2-pyrimidinecarboxamide

  • Molecular FormulaC9H12BrN3O
  • Average mass258.115 Da
  • Monoisotopic mass257.016357 Da
  • ChemSpider ID32058638

More details:






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

2-Pyrimidinecarboxamide, 5-bromo-N,N-diethyl- [ACD/Index Name]
5-Brom-N,N-diethyl-2-pyrimidincarboxamid [German] [ACD/IUPAC Name]
5-Bromo-N,N-diethyl-2-pyrimidinecarboxamide [ACD/IUPAC Name]
5-Bromo-N,N-diéthyl-2-pyrimidinecarboxamide [French] [ACD/IUPAC Name]
5-Bromo-N,N-diethylpyrimidine-2-carboxamide
911228-69-8 [RN]
[911228-69-8] [RN]
5-Bromo-pyrimidine-2-carboxylic acid diethylamide
MFCD18432633

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 344.6±34.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 58.9±3.0 kJ/mol
    Flash Point: 162.2±25.7 °C
    Index of Refraction: 1.554
    Molar Refractivity: 57.8±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.93
    ACD/LogD (pH 5.5): 0.91
    ACD/BCF (pH 5.5): 2.89
    ACD/KOC (pH 5.5): 74.46
    ACD/LogD (pH 7.4): 0.91
    ACD/BCF (pH 7.4): 2.89
    ACD/KOC (pH 7.4): 74.46
    Polar Surface Area: 46 Å2
    Polarizability: 22.9±0.5 10-24cm3
    Surface Tension: 48.6±3.0 dyne/cm
    Molar Volume: 180.4±3.0 cm3

    Click to predict properties on the Chemicalize site






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