ChemSpider 2D Image | 6-Fluoro-1,4-diazepane | C5H11FN2

6-Fluoro-1,4-diazepane

  • Molecular FormulaC5H11FN2
  • Average mass118.153 Da
  • Monoisotopic mass118.090630 Da
  • ChemSpider ID11389100

More details:

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

123187-94-0 [RN]
1H-1,4-Diazepine, 6-fluorohexahydro- [ACD/Index Name]
6-Fluor-1,4-diazepan [German] [ACD/IUPAC Name]
6-Fluoro-1,4-diazepane [ACD/IUPAC Name]
6-Fluoro-1,4-diazépane [French] [ACD/IUPAC Name]
"6-FLUORO-1,4-DIAZEPANE"|"6-FLUORO-1,4-DIAZEPANE"
6-Fluorohexahydro-1H-1,4-diazepine
MFCD19219847

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 174.3±40.0 °C at 760 mmHg
    Vapour Pressure: 1.2±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 41.1±3.0 kJ/mol
    Flash Point: 59.2±27.3 °C
    Index of Refraction: 1.449
    Molar Refractivity: 30.5±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 2
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: -0.64
    ACD/LogD (pH 5.5): -3.80
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.47
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 24 Å2
    Polarizability: 12.1±0.5 10-24cm3
    Surface Tension: 28.9±5.0 dyne/cm
    Molar Volume: 114.0±5.0 cm3

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