ChemSpider 2D Image | (2,2-difluoroethyl)[2-(3,4-dimethoxyphenyl)ethyl]amine | C12H17F2NO2

(2,2-difluoroethyl)[2-(3,4-dimethoxyphenyl)ethyl]amine

  • Molecular FormulaC12H17F2NO2
  • Average mass245.266 Da
  • Monoisotopic mass245.122742 Da
  • ChemSpider ID24751586

More details:

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

(2,2-difluoroethyl)[2-(3,4-dimethoxyphenyl)ethyl]amine
1182736-24-8 [RN]
Benzeneethanamine, N-(2,2-difluoroethyl)-3,4-dimethoxy- [ACD/Index Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-2,2-difluorethanamin [German] [ACD/IUPAC Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-2,2-difluoroethanamine [ACD/IUPAC Name]
N-[2-(3,4-Diméthoxyphényl)éthyl]-2,2-difluoroéthanamine [French] [ACD/IUPAC Name]
AGN-PC-08VYFH
AKOS005169342
MCULE-2019276898
MFCD12833075
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 309.7±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 55.0±3.0 kJ/mol
    Flash Point: 141.1±27.9 °C
    Index of Refraction: 1.470
    Molar Refractivity: 62.3±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 1.54
    ACD/LogD (pH 5.5): 0.69
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 14.57
    ACD/LogD (pH 7.4): 1.90
    ACD/BCF (pH 7.4): 15.48
    ACD/KOC (pH 7.4): 232.66
    Polar Surface Area: 30 Å2
    Polarizability: 24.7±0.5 10-24cm3
    Surface Tension: 29.6±3.0 dyne/cm
    Molar Volume: 223.4±3.0 cm3

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