ChemSpider 2D Image | 1-{[4-(Trifluoromethyl)benzyl]oxy}-2-butanamine | C12H16F3NO

1-{[4-(Trifluoromethyl)benzyl]oxy}-2-butanamine

  • Molecular FormulaC12H16F3NO
  • Average mass247.257 Da
  • Monoisotopic mass247.118393 Da
  • ChemSpider ID32841135

More details:

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

1-{[4-(Trifluormethyl)benzyl]oxy}-2-butanamin [German] [ACD/IUPAC Name]
1-{[4-(Trifluoromethyl)benzyl]oxy}-2-butanamine [ACD/IUPAC Name]
1-{[4-(Trifluorométhyl)benzyl]oxy}-2-butanamine [French] [ACD/IUPAC Name]
2-Butanamine, 1-[[4-(trifluoromethyl)phenyl]methoxy]- [ACD/Index Name]
1-((4-(Trifluoromethyl)benzyl)oxy)butan-2-amine
1-(4-Trifluoromethyl-benzyloxymethyl)-propylamine
1-[[4-(trifluoromethyl)phenyl]methoxy]butan-2-amine
1-{[4-(TRIFLUOROMETHYL)PHENYL]METHOXY}BUTAN-2-AMINE
1779134-91-6 [RN]
MFCD26128554

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 282.6±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 52.2±3.0 kJ/mol
    Flash Point: 124.7±25.9 °C
    Index of Refraction: 1.468
    Molar Refractivity: 59.9±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 2.87
    ACD/LogD (pH 5.5): -0.05
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.09
    ACD/LogD (pH 7.4): 1.44
    ACD/BCF (pH 7.4): 3.41
    ACD/KOC (pH 7.4): 33.89
    Polar Surface Area: 35 Å2
    Polarizability: 23.8±0.5 10-24cm3
    Surface Tension: 30.4±3.0 dyne/cm
    Molar Volume: 215.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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