ChemSpider 2D Image | 2-(3,4-Dichlorophenyl)-N-(~2~H_3_)methyl-N-[2-(1-pyrrolidinyl)ethyl](1,1-~2~H_2_)ethanamine | C15H17D5Cl2N2

2-(3,4-Dichlorophenyl)-N-(2H3)methyl-N-[2-(1-pyrrolidinyl)ethyl](1,1-2H2)ethanamine

  • Molecular FormulaC15H17D5Cl2N2
  • Average mass306.285 Da
  • Monoisotopic mass305.147400 Da
  • ChemSpider ID48058925

  • Non-standard isotope - Non-standard isotope

More details:

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

1-Pyrrolidineethanamine, N-[2-(3,4-dichlorophenyl)ethyl-1,1-d2]-N-(methyl-d3)- [ACD/Index Name]
2-(3,4-Dichlorophenyl)-N-(2H3)methyl-N-[2-(1-pyrrolidinyl)ethyl](1,1-2H2)ethanamine [ACD/IUPAC Name]
2-(3,4-Dichlorophényl)-N-(2H3)méthyl-N-[2-(1-pyrrolidinyl)éthyl](1,1-2H2)éthanamine [French] [ACD/IUPAC Name]
2-(3,4-Dichlorphenyl)-N-(2H3)methyl-N-[2-(1-pyrrolidinyl)ethyl](1,1-2H2)ethanamin [German] [ACD/IUPAC Name]
1,1-dideuterio-2-(3,4-dichlorophenyl)-N-(2-pyrrolidin-1-ylethyl)-N-(trideuteriomethyl)ethanamine
1246817-16-2 [RN]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 390.2±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.0±3.0 kJ/mol
    Flash Point: 189.8±27.9 °C
    Index of Refraction: 1.557
    Molar Refractivity: 83.2±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 4.05
    ACD/LogD (pH 5.5): 0.32
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 2.30
    ACD/BCF (pH 7.4): 13.20
    ACD/KOC (pH 7.4): 74.53
    Polar Surface Area: 6 Å2
    Polarizability: 33.0±0.5 10-24cm3
    Surface Tension: 42.8±3.0 dyne/cm
    Molar Volume: 258.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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