ChemSpider 2D Image | 5-Bromo-3-methyl-1H-pyrazolo[3,4-b]pyridine | C7H6BrN3

5-Bromo-3-methyl-1H-pyrazolo[3,4-b]pyridine

  • Molecular FormulaC7H6BrN3
  • Average mass212.047 Da
  • Monoisotopic mass210.974503 Da
  • ChemSpider ID24540152

More details:

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

1H-Pyrazolo[3,4-b]pyridine, 5-bromo-3-methyl- [ACD/Index Name]
5-Brom-3-methyl-1H-pyrazolo[3,4-b]pyridin [German] [ACD/IUPAC Name]
5-Bromo-3-methyl-1H-pyrazolo[3,4-b]pyridine [ACD/IUPAC Name]
5-Bromo-3-méthyl-1H-pyrazolo[3,4-b]pyridine [French] [ACD/IUPAC Name]
885223-65-4 [RN]
[885223-65-4] [RN]
5-bromo-3-methyl-1h-pyrazolo(3,4-b)pyridine
5-Bromo-3-Methyl-1H-Pyrazolo[3,4-b]Pyridine (en)
5-Bromo-3-methyl-2H-pyrazolo[3,4-b]pyridine
5-bromo-3-methylpyrazolo[5,4-b]pyridine
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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: 1.8±0.1 g/cm3
    Boiling Point: 339.7±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.0±3.0 kJ/mol
    Flash Point: 159.2±26.5 °C
    Index of Refraction: 1.711
    Molar Refractivity: 47.2±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 1.86
    ACD/LogD (pH 5.5): 1.83
    ACD/BCF (pH 5.5): 14.54
    ACD/KOC (pH 5.5): 236.45
    ACD/LogD (pH 7.4): 1.82
    ACD/BCF (pH 7.4): 14.23
    ACD/KOC (pH 7.4): 231.40
    Polar Surface Area: 42 Å2
    Polarizability: 18.7±0.5 10-24cm3
    Surface Tension: 68.2±3.0 dyne/cm
    Molar Volume: 120.8±3.0 cm3

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