ChemSpider 2D Image | 4-(Trifluoromethyl)(~2~H_4_)aniline | C7H2D4F3N

4-(Trifluoromethyl)(2H4)aniline

  • Molecular FormulaC7H2D4F3N
  • Average mass165.149 Da
  • Monoisotopic mass165.070343 Da
  • ChemSpider ID24533009
  • Non-standard isotope - Non-standard isotope


More details:






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

4-(Trifluormethyl)(2H4)anilin [German] [ACD/IUPAC Name]
4-(Trifluoromethyl)(2H4)aniline [ACD/IUPAC Name]
4-(Trifluorométhyl)(2H4)aniline [French] [ACD/IUPAC Name]
Benzen-2,3,5,6-d4-amine, 4-(trifluoromethyl)- [ACD/Index Name]
1219795-48-8 [RN]
4-(trifluoromethyl)(²H?)aniline
4-(trifluoromethyl)(²H?)aniline
4-(Trifluoromethyl)aniline-2,3,5,6-d4
4-Aminobenzotrifluoride
4-Trifluoromethylaminobenzene-2,3,5,6-d4
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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: 190.0±40.0 °C at 760 mmHg
    Vapour Pressure: 0.6±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 42.6±3.0 kJ/mol
    Flash Point: 86.7±0.0 °C
    Index of Refraction: 1.478
    Molar Refractivity: 35.5±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.95
    ACD/LogD (pH 5.5): 2.12
    ACD/BCF (pH 5.5): 24.12
    ACD/KOC (pH 5.5): 339.54
    ACD/LogD (pH 7.4): 2.12
    ACD/BCF (pH 7.4): 24.16
    ACD/KOC (pH 7.4): 340.16
    Polar Surface Area: 26 Å2
    Polarizability: 14.1±0.5 10-24cm3
    Surface Tension: 28.9±3.0 dyne/cm
    Molar Volume: 125.2±3.0 cm3

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