ChemSpider 2D Image | 1-(3,4-Diethoxyphenyl)-1-[3-(2-fluorophenyl)-1H-1,2,4-triazol-5-yl]methanamine | C19H21FN4O2

1-(3,4-Diethoxyphenyl)-1-[3-(2-fluorophenyl)-1H-1,2,4-triazol-5-yl]methanamine

  • Molecular FormulaC19H21FN4O2
  • Average mass356.394 Da
  • Monoisotopic mass356.164856 Da
  • ChemSpider ID29359894

More details:

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

1-(3,4-Diethoxyphenyl)-1-[3-(2-fluorophenyl)-1H-1,2,4-triazol-5-yl]methanamine [ACD/IUPAC Name]
1-(3,4-Diéthoxyphényl)-1-[3-(2-fluorophényl)-1H-1,2,4-triazol-5-yl]méthanamine [French] [ACD/IUPAC Name]
1-(3,4-Diethoxyphenyl)-1-[3-(2-fluorphenyl)-1H-1,2,4-triazol-5-yl]methanamin [German] [ACD/IUPAC Name]
1H-1,2,4-Triazole-3-methanamine, α-(3,4-diethoxyphenyl)-5-(2-fluorophenyl)- [ACD/Index Name]
(3,4-Diethoxyphenyl)(5-(2-fluorophenyl)-1H-1,2,4-triazol-3-yl)methanamine
(3,4-diethoxyphenyl)-[3-(2-fluorophenyl)-1H-1,2,4-triazol-5-yl]methanamine
(3,4-diethoxyphenyl)-[5-(2-fluorophenyl)-1H-1,2,4-triazol-3-yl]methanamine
1708159-43-6 [RN]
AKOS016054193
MFCD26526663

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 557.0±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 83.9±3.0 kJ/mol
    Flash Point: 290.7±32.9 °C
    Index of Refraction: 1.587
    Molar Refractivity: 96.9±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 3
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 3.36
    ACD/LogD (pH 5.5): 2.13
    ACD/BCF (pH 5.5): 16.55
    ACD/KOC (pH 5.5): 164.93
    ACD/LogD (pH 7.4): 2.78
    ACD/BCF (pH 7.4): 75.36
    ACD/KOC (pH 7.4): 750.99
    Polar Surface Area: 86 Å2
    Polarizability: 38.4±0.5 10-24cm3
    Surface Tension: 50.0±3.0 dyne/cm
    Molar Volume: 288.5±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement