ChemSpider 2D Image | 1-(4-Bromobutyl)-2-pyrrolidinone | C8H14BrNO

1-(4-Bromobutyl)-2-pyrrolidinone

  • Molecular FormulaC8H14BrNO
  • Average mass220.107 Da
  • Monoisotopic mass219.025864 Da
  • ChemSpider ID13418735

More details:

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

1-(4-Brombutyl)-2-pyrrolidinon [German] [ACD/IUPAC Name]
1-(4-Bromobutyl)-2-pyrrolidinone [ACD/IUPAC Name]
1-(4-Bromobutyl)-2-pyrrolidinone [French] [ACD/IUPAC Name]
2-Pyrrolidinone, 1-(4-bromobutyl)- [ACD/Index Name]
1-(4-bromobutyl)pyrrolidin-2-one
134578-93-1 [RN]
MFCD11213733 [MDL number]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 326.0±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.8±3.0 kJ/mol
    Flash Point: 151.0±23.2 °C
    Index of Refraction: 1.518
    Molar Refractivity: 48.5±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.27
    ACD/LogD (pH 5.5): 1.73
    ACD/BCF (pH 5.5): 12.13
    ACD/KOC (pH 5.5): 207.74
    ACD/LogD (pH 7.4): 1.73
    ACD/BCF (pH 7.4): 12.13
    ACD/KOC (pH 7.4): 207.74
    Polar Surface Area: 20 Å2
    Polarizability: 19.2±0.5 10-24cm3
    Surface Tension: 41.1±3.0 dyne/cm
    Molar Volume: 160.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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