ChemSpider 2D Image | 3-(3-Nitrophenyl)-1,4-diazaspiro[4.4]nonan-2-one | C13H15N3O3

3-(3-Nitrophenyl)-1,4-diazaspiro[4.4]nonan-2-one

  • Molecular FormulaC13H15N3O3
  • Average mass261.276 Da
  • Monoisotopic mass261.111328 Da
  • ChemSpider ID26403805

More details:

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

1,4-Diazaspiro[4.4]nonan-2-one, 3-(3-nitrophenyl)- [ACD/Index Name]
1272755-82-4 [RN]
3-(3-Nitrophenyl)-1,4-diazaspiro[4.4]nonan-2-on [German] [ACD/IUPAC Name]
3-(3-Nitrophenyl)-1,4-diazaspiro[4.4]nonan-2-one [ACD/IUPAC Name]
3-(3-Nitrophényl)-1,4-diazaspiro[4.4]nonan-2-one [French] [ACD/IUPAC Name]
15862-30-3 [RN]
2-(3-nitrophenyl)-1,4-diazaspiro[4.4]nonan-3-one
MFCD18651739 [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: 507.6±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 77.8±3.0 kJ/mol
    Flash Point: 260.8±30.1 °C
    Index of Refraction: 1.630
    Molar Refractivity: 68.5±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.41
    ACD/LogD (pH 5.5): 0.90
    ACD/BCF (pH 5.5): 2.85
    ACD/KOC (pH 5.5): 73.17
    ACD/LogD (pH 7.4): 0.92
    ACD/BCF (pH 7.4): 2.92
    ACD/KOC (pH 7.4): 74.96
    Polar Surface Area: 87 Å2
    Polarizability: 27.2±0.5 10-24cm3
    Surface Tension: 60.9±5.0 dyne/cm
    Molar Volume: 192.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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