ChemSpider 2D Image | 5-Bromo-1H-pyrazolo[3,4-c]pyridine | C6H4BrN3

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

  • Molecular FormulaC6H4BrN3
  • Average mass198.020 Da
  • Monoisotopic mass196.958847 Da
  • ChemSpider ID22525035

More details:

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

1H-Pyrazolo[3,4-c]pyridine, 5-bromo- [ACD/Index Name]
5-Brom-1H-pyrazolo[3,4-c]pyridin [German] [ACD/IUPAC Name]
5-Bromo-1H-pyrazolo[3,4-c]pyridine [ACD/IUPAC Name]
5-Bromo-1H-pyrazolo[3,4-c]pyridine [French] [ACD/IUPAC Name]
929617-35-6 [RN]
MFCD11518975 [MDL number]
[929617-35-6] [RN]
2,3-Dihydro-1H-pyrrolo[3,2-c]pyridin-6(5H)-one
4549-33-1 [RN]
5-bromo-1h-pyrazolo 3,4-c 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: 1.9±0.1 g/cm3
    Boiling Point: 384.0±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.8±3.0 kJ/mol
    Flash Point: 186.0±22.3 °C
    Index of Refraction: 1.746
    Molar Refractivity: 42.4±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 1.13
    ACD/LogD (pH 5.5): 1.29
    ACD/BCF (pH 5.5): 5.60
    ACD/KOC (pH 5.5): 117.70
    ACD/LogD (pH 7.4): 1.31
    ACD/BCF (pH 7.4): 5.85
    ACD/KOC (pH 7.4): 123.03
    Polar Surface Area: 42 Å2
    Polarizability: 16.8±0.5 10-24cm3
    Surface Tension: 76.9±3.0 dyne/cm
    Molar Volume: 104.5±3.0 cm3

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