ChemSpider 2D Image | 1-[3-(5-Bromo-2-methylphenoxy)propyl]-4-methylpiperazine | C15H23BrN2O

1-[3-(5-Bromo-2-methylphenoxy)propyl]-4-methylpiperazine

  • Molecular FormulaC15H23BrN2O
  • Average mass327.260 Da
  • Monoisotopic mass326.099365 Da
  • ChemSpider ID32076396

More details:

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

1-[3-(5-Brom-2-methylphenoxy)propyl]-4-methylpiperazin [German] [ACD/IUPAC Name]
1-[3-(5-Bromo-2-methylphenoxy)propyl]-4-methylpiperazine [ACD/IUPAC Name]
1-[3-(5-Bromo-2-méthylphénoxy)propyl]-4-méthylpipérazine [French] [ACD/IUPAC Name]
Piperazine, 1-[3-(5-bromo-2-methylphenoxy)propyl]-4-methyl- [ACD/Index Name]
1-(3-(5-bromo-2-methylphenoxy)propyl)-4-methylpiperazine
1704065-42-8 [RN]
1993-03-9 [RN]
MFCD28400231

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 409.3±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.2±3.0 kJ/mol
    Flash Point: 201.4±28.7 °C
    Index of Refraction: 1.543
    Molar Refractivity: 83.0±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.99
    ACD/LogD (pH 5.5): 0.94
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 7.00
    ACD/LogD (pH 7.4): 2.65
    ACD/BCF (pH 7.4): 44.05
    ACD/KOC (pH 7.4): 357.51
    Polar Surface Area: 16 Å2
    Polarizability: 32.9±0.5 10-24cm3
    Surface Tension: 38.7±3.0 dyne/cm
    Molar Volume: 263.5±3.0 cm3

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