ChemSpider 2D Image | 6-Bromo-3-(1-isopropyl-1,2,3,6-tetrahydro-4-pyridinyl)-1H-indole | C16H19BrN2

6-Bromo-3-(1-isopropyl-1,2,3,6-tetrahydro-4-pyridinyl)-1H-indole

  • Molecular FormulaC16H19BrN2
  • Average mass319.240 Da
  • Monoisotopic mass318.073151 Da
  • ChemSpider ID58810325

More details:






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

1958100-90-7 [RN]
1H-Indole, 6-bromo-3-[1,2,3,6-tetrahydro-1-(1-methylethyl)-4-pyridinyl]- [ACD/Index Name]
6-Brom-3-(1-isopropyl-1,2,3,6-tetrahydro-4-pyridinyl)-1H-indol [German] [ACD/IUPAC Name]
6-Bromo-3-(1-isopropyl-1,2,3,6-tetrahydro-4-pyridinyl)-1H-indole [ACD/IUPAC Name]
6-Bromo-3-(1-isopropyl-1,2,3,6-tétrahydro-4-pyridinyl)-1H-indole [French] [ACD/IUPAC Name]
6-BROMO-3-(1-ISOPROPYL-1,2,3,6-TETRAHYDROPYRIDIN-4-YL)-1H-INDOLE
MFCD30471739

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 452.3±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 71.1±3.0 kJ/mol
    Flash Point: 227.3±28.7 °C
    Index of Refraction: 1.643
    Molar Refractivity: 84.5±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.85
    ACD/LogD (pH 5.5): 1.03
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 3.92
    ACD/LogD (pH 7.4): 2.40
    ACD/BCF (pH 7.4): 16.49
    ACD/KOC (pH 7.4): 92.29
    Polar Surface Area: 19 Å2
    Polarizability: 33.5±0.5 10-24cm3
    Surface Tension: 49.6±3.0 dyne/cm
    Molar Volume: 233.7±3.0 cm3

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