ChemSpider 2D Image | (1-ethyl-2-methanesulfonyl-1H-imidazol-5-yl)methanol | C7H12N2O3S

(1-ethyl-2-methanesulfonyl-1H-imidazol-5-yl)methanol

  • Molecular FormulaC7H12N2O3S
  • Average mass204.247 Da
  • Monoisotopic mass204.056870 Da
  • ChemSpider ID24531848

More details:

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

(1-ethyl-2-methanesulfonyl-1H-imidazol-5-yl)methanol
[1-Ethyl-2-(methylsulfonyl)-1H-imidazol-5-yl]methanol [ACD/IUPAC Name]
[1-Ethyl-2-(methylsulfonyl)-1H-imidazol-5-yl]methanol [German] [ACD/IUPAC Name]
[1-Éthyl-2-(méthylsulfonyl)-1H-imidazol-5-yl]méthanol [French] [ACD/IUPAC Name]
1221341-97-4 [RN]
1H-Imidazole-5-methanol, 1-ethyl-2-(methylsulfonyl)- [ACD/Index Name]
(1-Ethyl-2-(methylsulfonyl)-1H-imidazol-5-yl)methanol
(3-ethyl-2-methylsulfonylimidazol-4-yl)methanol
atoms 13 bonds 13
MFCD14707590

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 421.9±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 71.3±3.0 kJ/mol
    Flash Point: 208.9±26.5 °C
    Index of Refraction: 1.583
    Molar Refractivity: 49.5±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -1.22
    ACD/LogD (pH 5.5): -0.20
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 18.61
    ACD/LogD (pH 7.4): -0.20
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 18.62
    Polar Surface Area: 81 Å2
    Polarizability: 19.6±0.5 10-24cm3
    Surface Tension: 50.9±7.0 dyne/cm
    Molar Volume: 148.1±7.0 cm3

    Click to predict properties on the Chemicalize site


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