ChemSpider 2D Image | N-[(1S,2R)-1-Hydroxy-1-phenyl-2-propanyl]-N-methyl(~2~H_3_)acetamide | C12H14D3NO2

N-[(1S,2R)-1-Hydroxy-1-phenyl-2-propanyl]-N-methyl(2H3)acetamide

  • Molecular FormulaC12H14D3NO2
  • Average mass210.287 Da
  • Monoisotopic mass210.144760 Da
  • ChemSpider ID48057639

  • defined stereocentres - 2 of 2 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

Acetamide-d3, N-[(1R,2S)-2-hydroxy-1-methyl-2-phenylethyl]-N-methyl- [ACD/Index Name]
N-[(1S,2R)-1-Hydroxy-1-phenyl-2-propanyl]-N-methyl(2H3)acetamid [German] [ACD/IUPAC Name]
N-[(1S,2R)-1-Hydroxy-1-phenyl-2-propanyl]-N-methyl(2H3)acetamide [ACD/IUPAC Name]
N-[(1S,2R)-1-Hydroxy-1-phényl-2-propanyl]-N-méthyl(2H3)acétamide [French] [ACD/IUPAC Name]
1346604-10-1 [RN]
2,2,2-trideuterio-N-[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]-N-methylacetamide

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 361.2±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.1±3.0 kJ/mol
    Flash Point: 172.3±25.9 °C
    Index of Refraction: 1.535
    Molar Refractivity: 59.6±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.13
    ACD/LogD (pH 5.5): 1.32
    ACD/BCF (pH 5.5): 5.96
    ACD/KOC (pH 5.5): 124.93
    ACD/LogD (pH 7.4): 1.32
    ACD/BCF (pH 7.4): 5.96
    ACD/KOC (pH 7.4): 124.93
    Polar Surface Area: 41 Å2
    Polarizability: 23.6±0.5 10-24cm3
    Surface Tension: 41.9±3.0 dyne/cm
    Molar Volume: 191.3±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement