ChemSpider 2D Image | 1-[4-(3-Hydroxyphenyl)-1-methyl-4-piperidinyl]-1-(3,3,3-~2~H_3_)propanone | C15H18D3NO2

1-[4-(3-Hydroxyphenyl)-1-methyl-4-piperidinyl]-1-(3,3,3-2H3)propanone

  • Molecular FormulaC15H18D3NO2
  • Average mass250.351 Da
  • Monoisotopic mass250.176056 Da
  • ChemSpider ID48061864

  • Non-standard isotope - Non-standard isotope

More details:

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

1-[4-(3-Hydroxyphenyl)-1-methyl-4-piperidinyl]-1-(3,3,3-2H3)propanon [German] [ACD/IUPAC Name]
1-[4-(3-Hydroxyphenyl)-1-methyl-4-piperidinyl]-1-(3,3,3-2H3)propanone [ACD/IUPAC Name]
1-[4-(3-Hydroxyphényl)-1-méthyl-4-pipéridinyl]-1-(3,3,3-2H3)propanone [French] [ACD/IUPAC Name]
1-Propanone-3,3,3-d3, 1-[4-(3-hydroxyphenyl)-1-methyl-4-piperidinyl]- [ACD/Index Name]
1346601-42-0 [RN]
3,3,3-trideuterio-1-[4-(3-hydroxyphenyl)-1-methylpiperidin-4-yl]propan-1-one

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 391.3±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 66.6±3.0 kJ/mol
    Flash Point: 190.4±27.9 °C
    Index of Refraction: 1.544
    Molar Refractivity: 71.4±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.58
    ACD/LogD (pH 5.5): -0.67
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.19
    ACD/LogD (pH 7.4): 0.97
    ACD/BCF (pH 7.4): 2.58
    ACD/KOC (pH 7.4): 52.67
    Polar Surface Area: 41 Å2
    Polarizability: 28.3±0.5 10-24cm3
    Surface Tension: 42.5±3.0 dyne/cm
    Molar Volume: 226.3±3.0 cm3

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