ChemSpider 2D Image | 1-(4-Biphenylyl)-2-chloro-2-(ethylsulfonyl)-1-butanol | C18H21ClO3S

1-(4-Biphenylyl)-2-chloro-2-(ethylsulfonyl)-1-butanol

  • Molecular FormulaC18H21ClO3S
  • Average mass352.875 Da
  • Monoisotopic mass352.089996 Da
  • ChemSpider ID35495707

More details:

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

[1,1'-Biphenyl]-4-methanol, α-[1-chloro-1-(ethylsulfonyl)propyl]- [ACD/Index Name]
1-(4-Biphenylyl)-2-chlor-2-(ethylsulfonyl)-1-butanol [German] [ACD/IUPAC Name]
1-(4-Biphenylyl)-2-chloro-2-(ethylsulfonyl)-1-butanol [ACD/IUPAC Name]
1-(4-Biphénylyl)-2-chloro-2-(éthylsulfonyl)-1-butanol [French] [ACD/IUPAC Name]
1710847-19-0 [RN]
1-Biphenyl-4-yl-2-chloro-2-ethanesulfonyl-butan-1-ol
2-chloro-2-ethylsulfonyl-1-(4-phenylphenyl)butan-1-ol
MFCD26528058

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 553.8±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 87.8±3.0 kJ/mol
    Flash Point: 288.7±30.1 °C
    Index of Refraction: 1.579
    Molar Refractivity: 94.4±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 4.10
    ACD/LogD (pH 5.5): 3.79
    ACD/BCF (pH 5.5): 447.44
    ACD/KOC (pH 5.5): 2747.90
    ACD/LogD (pH 7.4): 3.79
    ACD/BCF (pH 7.4): 447.43
    ACD/KOC (pH 7.4): 2747.80
    Polar Surface Area: 63 Å2
    Polarizability: 37.4±0.5 10-24cm3
    Surface Tension: 48.1±3.0 dyne/cm
    Molar Volume: 284.3±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement