ChemSpider 2D Image | 4-((1-Cyanocyclobutyl)amino)-2-fluoro-N-methylbenzamide | C13H14FN3O

4-((1-Cyanocyclobutyl)amino)-2-fluoro-N-methylbenzamide

  • Molecular FormulaC13H14FN3O
  • Average mass247.268 Da
  • Monoisotopic mass247.112091 Da
  • ChemSpider ID29211712

More details:

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

4-((1-Cyanocyclobutyl)amino)-2-fluoro-N-methylbenzamide
4-[(1-Cyancyclobutyl)amino]-2-fluor-N-methylbenzamid [German] [ACD/IUPAC Name]
4-[(1-Cyanocyclobutyl)amino]-2-fluoro-N-methylbenzamide [ACD/IUPAC Name]
4-[(1-Cyanocyclobutyl)amino]-2-fluoro-N-méthylbenzamide [French] [ACD/IUPAC Name]
915087-26-2 [RN]
Benzamide, 4-[(1-cyanocyclobutyl)amino]-2-fluoro-N-methyl- [ACD/Index Name]
4-(1-CYANOCYCLOBUTYLAMINO)-2-FLUORO-N-METHYLBENZAMIDE
4-[(1-cyanocyclobutyl)amino]-N-methylbenzamide
95%
MFCD09909370 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 447.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.6±3.0 kJ/mol
    Flash Point: 224.4±28.7 °C
    Index of Refraction: 1.569
    Molar Refractivity: 64.6±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 0.37
    ACD/LogD (pH 5.5): 1.30
    ACD/BCF (pH 5.5): 5.70
    ACD/KOC (pH 5.5): 120.92
    ACD/LogD (pH 7.4): 1.30
    ACD/BCF (pH 7.4): 5.70
    ACD/KOC (pH 7.4): 120.92
    Polar Surface Area: 65 Å2
    Polarizability: 25.6±0.5 10-24cm3
    Surface Tension: 51.2±5.0 dyne/cm
    Molar Volume: 197.2±5.0 cm3

    Click to predict properties on the Chemicalize site


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