ChemSpider 2D Image | 3-(3-Fluorophenyl)-1-methyl-1,4,7-triazaspiro[4.5]dec-3-en-2-one | C14H16FN3O

3-(3-Fluorophenyl)-1-methyl-1,4,7-triazaspiro[4.5]dec-3-en-2-one

  • Molecular FormulaC14H16FN3O
  • Average mass261.295 Da
  • Monoisotopic mass261.127747 Da
  • ChemSpider ID35493736

More details:

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

1,4,7-Triazaspiro[4.5]dec-3-en-2-one, 3-(3-fluorophenyl)-1-methyl- [ACD/Index Name]
1708428-10-7 [RN]
3-(3-Fluorophenyl)-1-methyl-1,4,7-triazaspiro[4.5]dec-3-en-2-one [ACD/IUPAC Name]
3-(3-Fluorophényl)-1-méthyl-1,4,7-triazaspiro[4.5]déc-3-én-2-one [French] [ACD/IUPAC Name]
3-(3-Fluorphenyl)-1-methyl-1,4,7-triazaspiro[4.5]dec-3-en-2-on [German] [ACD/IUPAC Name]
2-(3-fluorophenyl)-4-methyl-1,4,9-triazaspiro[4.5]dec-1-en-3-one
3-(3-Fluoro-phenyl)-1-methyl-1,4,7-triaza-spiro[4.5]dec-3-en-2-one
MFCD26382315

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 386.5±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 63.5±3.0 kJ/mol
    Flash Point: 187.6±30.7 °C
    Index of Refraction: 1.634
    Molar Refractivity: 70.6±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.23
    ACD/LogD (pH 5.5): -1.40
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.23
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 2.58
    Polar Surface Area: 45 Å2
    Polarizability: 28.0±0.5 10-24cm3
    Surface Tension: 47.2±7.0 dyne/cm
    Molar Volume: 197.4±7.0 cm3

    Click to predict properties on the Chemicalize site


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