ChemSpider 2D Image | 2-(3,4,5-trifluorophenyl)aniline | C12H8F3N

2-(3,4,5-trifluorophenyl)aniline

  • Molecular FormulaC12H8F3N
  • Average mass223.194 Da
  • Monoisotopic mass223.060883 Da
  • ChemSpider ID28289947

More details:

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

[1,1'-Biphenyl]-2-amine, 3',4',5'-trifluoro- [ACD/Index Name]
15419654 [Beilstein]
2-(3,4,5-trifluorophenyl)aniline
3',4',5'-Trifluor-2-biphenylamin [German] [ACD/IUPAC Name]
3',4',5'-Trifluoro[1,1'-biphenyl]-2-amine
3',4',5'-Trifluoro-[1,1'-biphenyl]-2-amine [ACD/IUPAC Name]
3',4',5'-Trifluoro-2-biphenylamine
3',4',5'-Trifluoro-2-biphénylamine [French] [ACD/IUPAC Name]
915416-45-4 [RN]
ZR BR CF DF EF [WLN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

10XDA3W53S [DBID]
CCRIS 4693 [DBID]
UNII:10XDA3W53S [DBID]
UNII-10XDA3W53S [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 303.7±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 54.4±3.0 kJ/mol
    Flash Point: 134.9±19.2 °C
    Index of Refraction: 1.563
    Molar Refractivity: 55.1±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.52
    ACD/LogD (pH 5.5): 2.87
    ACD/BCF (pH 5.5): 89.26
    ACD/KOC (pH 5.5): 866.65
    ACD/LogD (pH 7.4): 2.87
    ACD/BCF (pH 7.4): 89.30
    ACD/KOC (pH 7.4): 867.04
    Polar Surface Area: 26 Å2
    Polarizability: 21.8±0.5 10-24cm3
    Surface Tension: 40.5±3.0 dyne/cm
    Molar Volume: 169.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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