ChemSpider 2D Image | 2-(3-Oxo-1,4-diazaspiro[4.4]non-2-yl)benzonitrile | C14H15N3O

2-(3-Oxo-1,4-diazaspiro[4.4]non-2-yl)benzonitrile

  • Molecular FormulaC14H15N3O
  • Average mass241.288 Da
  • Monoisotopic mass241.121506 Da
  • ChemSpider ID26403801

More details:

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

1272755-94-8 [RN]
2-(3-Oxo-1,4-diazaspiro[4.4]non-2-yl)benzonitril [German] [ACD/IUPAC Name]
2-(3-Oxo-1,4-diazaspiro[4.4]non-2-yl)benzonitrile [ACD/IUPAC Name]
2-(3-Oxo-1,4-diazaspiro[4.4]non-2-yl)benzonitrile [French] [ACD/IUPAC Name]
2-(3-Oxo-1,4-diazaspiro[4.4]nonan-2-yl)benzonitrile
Benzonitrile, 2-(2-oxo-1,4-diazaspiro[4.4]non-3-yl)-
Benzonitrile, 2-(3-oxo-1,4-diazaspiro[4.4]non-2-yl)- [ACD/Index Name]
[1272755-94-8] [RN]
566205-01-4 [RN]
ethyl 2-(4-(cyclopropylsulfonyl)phenyl)-2-oxoacetate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 504.1±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 77.3±3.0 kJ/mol
    Flash Point: 258.7±30.1 °C
    Index of Refraction: 1.621
    Molar Refractivity: 67.1±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.12
    ACD/LogD (pH 5.5): 0.77
    ACD/BCF (pH 5.5): 2.26
    ACD/KOC (pH 5.5): 61.84
    ACD/LogD (pH 7.4): 0.78
    ACD/BCF (pH 7.4): 2.32
    ACD/KOC (pH 7.4): 63.50
    Polar Surface Area: 65 Å2
    Polarizability: 26.6±0.5 10-24cm3
    Surface Tension: 59.1±5.0 dyne/cm
    Molar Volume: 190.7±5.0 cm3

    Click to predict properties on the Chemicalize site


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