ChemSpider 2D Image | 4-Nitrophenyl ethenesulfonate | C8H7NO5S

4-Nitrophenyl ethenesulfonate

  • Molecular FormulaC8H7NO5S
  • Average mass229.210 Da
  • Monoisotopic mass229.004486 Da
  • ChemSpider ID21836434

More details:

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

3058-53-5 [RN]
4-Nitrophenyl ethenesulfonate [ACD/IUPAC Name]
4-Nitrophenyl-ethensulfonat [German] [ACD/IUPAC Name]
Éthènesulfonate de 4-nitrophényle [French] [ACD/IUPAC Name]
Ethenesulfonic acid, 4-nitrophenyl ester [ACD/Index Name]
(4-nitrophenyl) ethenesulfonate
Ethenesulfonic acid 4-nitro-phenyl ester

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 289.2±23.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 50.7±3.0 kJ/mol
    Flash Point: 128.7±22.6 °C
    Index of Refraction: 1.578
    Molar Refractivity: 52.4±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.21
    ACD/LogD (pH 5.5): 1.93
    ACD/BCF (pH 5.5): 17.20
    ACD/KOC (pH 5.5): 266.73
    ACD/LogD (pH 7.4): 1.93
    ACD/BCF (pH 7.4): 17.20
    ACD/KOC (pH 7.4): 266.73
    Polar Surface Area: 98 Å2
    Polarizability: 20.8±0.5 10-24cm3
    Surface Tension: 55.7±3.0 dyne/cm
    Molar Volume: 157.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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