ChemSpider 2D Image | 1-(3,4-Dimethylphenyl)(2,2,2-~2~H_3_)ethanol | C10H11D3O

1-(3,4-Dimethylphenyl)(2,2,2-2H3)ethanol

  • Molecular FormulaC10H11D3O
  • Average mass153.236 Da
  • Monoisotopic mass153.123291 Da
  • ChemSpider ID48063166

  • Non-standard isotope - Non-standard isotope

More details:

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

1-(3,4-Dimethylphenyl)(2,2,2-2H3)ethanol [German] [ACD/IUPAC Name]
1-(3,4-Dimethylphenyl)(2,2,2-2H3)ethanol [ACD/IUPAC Name]
1-(3,4-Diméthylphényl)(2,2,2-2H3)éthanol [French] [ACD/IUPAC Name]
Benzenemethanol, 3,4-dimethyl-α-(methyl-d3)- [ACD/Index Name]
1-(3,4-Dimethylphenyl)ethanol-d3
159754-92-4 [RN]

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 225.8±8.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 48.9±3.0 kJ/mol
    Flash Point: 100.0±8.9 °C
    Index of Refraction: 1.526
    Molar Refractivity: 47.0±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.30
    ACD/LogD (pH 5.5): 2.31
    ACD/BCF (pH 5.5): 33.65
    ACD/KOC (pH 5.5): 431.19
    ACD/LogD (pH 7.4): 2.31
    ACD/BCF (pH 7.4): 33.65
    ACD/KOC (pH 7.4): 431.19
    Polar Surface Area: 20 Å2
    Polarizability: 18.6±0.5 10-24cm3
    Surface Tension: 35.9±3.0 dyne/cm
    Molar Volume: 153.1±3.0 cm3

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