ChemSpider 2D Image | (1S)-1-(3,4-Dimethoxyphenyl)ethanol | C10H14O3

(1S)-1-(3,4-Dimethoxyphenyl)ethanol

  • Molecular FormulaC10H14O3
  • Average mass182.216 Da
  • Monoisotopic mass182.094299 Da
  • ChemSpider ID22837023

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1S)-1-(3,4-Dimethoxyphenyl)ethanol [ACD/IUPAC Name]
(1S)-1-(3,4-Dimethoxyphenyl)ethanol [German] [ACD/IUPAC Name]
(1S)-1-(3,4-Diméthoxyphényl)éthanol [French] [ACD/IUPAC Name]
Benzenemethanol, 3,4-dimethoxy-α-methyl-, (αS)- [ACD/Index Name]
(1S)-1-(3,4-dimethoxyphenyl)ethan-1-ol
(1S)-1-(3,4-dimethoxy-phenyl)ethanol
(S)-1-(3,4-dimethoxyphenyl)ethanol
109926-15-0 [RN]
183072-05-1 [RN]
MFCD09863679 [MDL number]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 284.7±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 55.3±3.0 kJ/mol
    Flash Point: 126.0±25.9 °C
    Index of Refraction: 1.514
    Molar Refractivity: 50.7±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.12
    ACD/LogD (pH 5.5): 1.23
    ACD/BCF (pH 5.5): 5.07
    ACD/KOC (pH 5.5): 111.27
    ACD/LogD (pH 7.4): 1.23
    ACD/BCF (pH 7.4): 5.07
    ACD/KOC (pH 7.4): 111.27
    Polar Surface Area: 39 Å2
    Polarizability: 20.1±0.5 10-24cm3
    Surface Tension: 35.9±3.0 dyne/cm
    Molar Volume: 168.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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