ChemSpider 2D Image | N-[(2R)-1-(~2~H_5_)Phenyl-2-propanyl]-2-propyn-1-amine | C12H10D5N

N-[(2R)-1-(2H5)Phenyl-2-propanyl]-2-propyn-1-amine

  • Molecular FormulaC12H10D5N
  • Average mass178.285 Da
  • Monoisotopic mass178.151840 Da
  • ChemSpider ID48059324

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

Benzene-2,3,4,5,6-d5-ethanamine, α-methyl-N-2-propyn-1-yl-, (αR)- [ACD/Index Name]
N-[(2R)-1-(2H5)Phenyl-2-propanyl]-2-propin-1-amin [German] [ACD/IUPAC Name]
N-[(2R)-1-(2H5)Phenyl-2-propanyl]-2-propyn-1-amine [ACD/IUPAC Name]
N-[(2R)-1-(2H5)Phényl-2-propanyl]-2-propyn-1-amine [French] [ACD/IUPAC Name]
(2R)-1-(2,3,4,5,6-pentadeuteriophenyl)-N-prop-2-ynylpropan-2-amine
1217977-04-2 [RN]
r-(-)-n-demethyl deprenyl-d5

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 275.3±15.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 51.4±3.0 kJ/mol
    Flash Point: 121.7±15.8 °C
    Index of Refraction: 1.527
    Molar Refractivity: 55.7±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.39
    ACD/LogD (pH 5.5): 0.17
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 2.53
    ACD/LogD (pH 7.4): 1.87
    ACD/BCF (pH 7.4): 11.01
    ACD/KOC (pH 7.4): 128.33
    Polar Surface Area: 12 Å2
    Polarizability: 22.1±0.5 10-24cm3
    Surface Tension: 37.1±3.0 dyne/cm
    Molar Volume: 181.2±3.0 cm3

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