ChemSpider 2D Image | 5-Bromo-1H-pyrrole-3-carbaldehyde | C5H4BrNO

5-Bromo-1H-pyrrole-3-carbaldehyde

  • Molecular FormulaC5H4BrNO
  • Average mass173.995 Da
  • Monoisotopic mass172.947617 Da
  • ChemSpider ID29309952

More details:

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

1H-Pyrrole-3-carboxaldehyde, 5-bromo- [ACD/Index Name]
5-Brom-1H-pyrrol-3-carbaldehyd [German] [ACD/IUPAC Name]
5-Bromo-1H-pyrrole-3-carbaldehyde [ACD/IUPAC Name]
5-Bromo-1H-pyrrole-3-carbaldéhyde [French] [ACD/IUPAC Name]
881676-32-0 [RN]
1H-Pyrrole-3-carbaldehyde,5-bromo-
1H-Pyrrole-3-carboxaldehyde,5-bromo-
4,6-Diamino-5-nitropyrimidine
5-bromo-1H-Pyrrole-3-carboxaldehyde
MFCD11875943 [MDL number]

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

    Density: 1.8±0.1 g/cm3
    Boiling Point: 299.6±20.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 54.0±3.0 kJ/mol
    Flash Point: 135.0±21.8 °C
    Index of Refraction: 1.656
    Molar Refractivity: 35.1±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.35
    ACD/LogD (pH 5.5): 1.57
    ACD/BCF (pH 5.5): 9.20
    ACD/KOC (pH 5.5): 170.45
    ACD/LogD (pH 7.4): 1.57
    ACD/BCF (pH 7.4): 9.20
    ACD/KOC (pH 7.4): 170.45
    Polar Surface Area: 33 Å2
    Polarizability: 13.9±0.5 10-24cm3
    Surface Tension: 56.8±3.0 dyne/cm
    Molar Volume: 95.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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