ChemSpider 2D Image | (2-Bromo-1-hexyl-1H-pyrrol-3-yl)(1-naphthyl)methanone | C21H22BrNO

(2-Bromo-1-hexyl-1H-pyrrol-3-yl)(1-naphthyl)methanone

  • Molecular FormulaC21H22BrNO
  • Average mass384.310 Da
  • Monoisotopic mass383.088470 Da
  • ChemSpider ID48061833

More details:

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

(2-Brom-1-hexyl-1H-pyrrol-3-yl)(1-naphthyl)methanon [German] [ACD/IUPAC Name]
(2-Bromo-1-hexyl-1H-pyrrol-3-yl)(1-naphthyl)methanone [ACD/IUPAC Name]
(2-Bromo-1-hexyl-1H-pyrrol-3-yl)(1-naphtyl)méthanone [French] [ACD/IUPAC Name]
Methanone, (2-bromo-1-hexyl-1H-pyrrol-3-yl)-1-naphthalenyl- [ACD/Index Name]
(2-Bromo-1-hexyl-1H-pyrrol-3-yl)(naphthalen-1-yl)methanone
(2-bromo-1-hexylpyrrol-3-yl)-naphthalen-1-ylmethanone
1346598-61-5 [RN]
1-Hexyl-2-bromo-3-(1-naphthoyl)pyrrole

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 505.5±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 77.5±3.0 kJ/mol
    Flash Point: 259.5±24.6 °C
    Index of Refraction: 1.597
    Molar Refractivity: 103.9±0.5 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 1
    ACD/LogP: 6.71
    ACD/LogD (pH 5.5): 6.94
    ACD/BCF (pH 5.5): 111093.86
    ACD/KOC (pH 5.5): 142325.78
    ACD/LogD (pH 7.4): 6.94
    ACD/BCF (pH 7.4): 111093.86
    ACD/KOC (pH 7.4): 142325.78
    Polar Surface Area: 22 Å2
    Polarizability: 41.2±0.5 10-24cm3
    Surface Tension: 42.1±7.0 dyne/cm
    Molar Volume: 304.8±7.0 cm3

    Click to predict properties on the Chemicalize site


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