ChemSpider 2D Image | 4-(Ethylsulfonyl)-1H-pyrazole | C5H8N2O2S

4-(Ethylsulfonyl)-1H-pyrazole

  • Molecular FormulaC5H8N2O2S
  • Average mass160.194 Da
  • Monoisotopic mass160.030655 Da
  • ChemSpider ID35495950

More details:

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

1707400-15-4 [RN]
1H-Pyrazole, 4-(ethylsulfonyl)- [ACD/Index Name]
4-(ethanesulfonyl)-1H-pyrazole
4-(Ethylsulfonyl)-1H-pyrazol [German] [ACD/IUPAC Name]
4-(Ethylsulfonyl)-1H-pyrazole [ACD/IUPAC Name]
4-(Éthylsulfonyl)-1H-pyrazole [French] [ACD/IUPAC Name]
4-Ethanesulfonyl-1H-pyrazole
4-ethylsulfonyl-1H-pyrazole
AGN-PC-0BOAO6
MFCD26528299

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 425.7±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 65.4±3.0 kJ/mol
    Flash Point: 211.3±23.7 °C
    Index of Refraction: 1.525
    Molar Refractivity: 36.6±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.47
    ACD/LogD (pH 5.5): -0.18
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 18.91
    ACD/LogD (pH 7.4): -0.19
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 18.82
    Polar Surface Area: 71 Å2
    Polarizability: 14.5±0.5 10-24cm3
    Surface Tension: 52.0±3.0 dyne/cm
    Molar Volume: 119.3±3.0 cm3

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