ChemSpider 2D Image | 2-[(Dimethylamino)methyl]-4-fluoroaniline | C9H13FN2

2-[(Dimethylamino)methyl]-4-fluoroaniline

  • Molecular FormulaC9H13FN2
  • Average mass168.211 Da
  • Monoisotopic mass168.106277 Da
  • ChemSpider ID25075984

More details:

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

1153396-50-9 [RN]
2-[(Dimethylamino)methyl]-4-fluoranilin [German] [ACD/IUPAC Name]
2-[(Dimethylamino)methyl]-4-fluoroaniline [ACD/IUPAC Name]
2-[(Diméthylamino)méthyl]-4-fluoroaniline [French] [ACD/IUPAC Name]
Benzenemethanamine, 2-amino-5-fluoro-N,N-dimethyl- [ACD/Index Name]
2-((dimethylamino)methyl)-4-fluoroaniline
MFCD12171389 [MDL number]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 234.3±25.0 °C at 760 mmHg
    Vapour Pressure: 0.1±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 47.1±3.0 kJ/mol
    Flash Point: 95.5±23.2 °C
    Index of Refraction: 1.547
    Molar Refractivity: 48.4±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.91
    ACD/LogD (pH 5.5): -1.59
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.03
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 7.45
    Polar Surface Area: 29 Å2
    Polarizability: 19.2±0.5 10-24cm3
    Surface Tension: 39.5±3.0 dyne/cm
    Molar Volume: 152.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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