ChemSpider 2D Image | (1R)-1-(2,3,4-Trichlorophenyl)ethanol | C8H7Cl3O

(1R)-1-(2,3,4-Trichlorophenyl)ethanol

  • Molecular FormulaC8H7Cl3O
  • Average mass225.500 Da
  • Monoisotopic mass223.956253 Da
  • ChemSpider ID22837026

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1R)-1-(2,3,4-Trichlorophenyl)ethanol [ACD/IUPAC Name]
(1R)-1-(2,3,4-Trichlorophényl)éthanol [French] [ACD/IUPAC Name]
(1R)-1-(2,3,4-Trichlorphenyl)ethanol [German] [ACD/IUPAC Name]
Benzenemethanol, 2,3,4-trichloro-α-methyl-, (αR)- [ACD/Index Name]
(1R)-1-(2,3,4-trichlorophenyl)ethan-1-ol
(αR)-2,3,4-trichloro-α-methylbenzenemethanol
460052-36-2 [RN]
MFCD09863684 [MDL number]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 301.3±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.2±3.0 kJ/mol
    Flash Point: 136.0±26.5 °C
    Index of Refraction: 1.580
    Molar Refractivity: 52.0±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.93
    ACD/LogD (pH 5.5): 3.29
    ACD/BCF (pH 5.5): 185.57
    ACD/KOC (pH 5.5): 1463.51
    ACD/LogD (pH 7.4): 3.29
    ACD/BCF (pH 7.4): 185.56
    ACD/KOC (pH 7.4): 1463.51
    Polar Surface Area: 20 Å2
    Polarizability: 20.6±0.5 10-24cm3
    Surface Tension: 45.9±3.0 dyne/cm
    Molar Volume: 156.4±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement