ChemSpider 2D Image | 3-Phenyl-1,2-benzoxazol-6-yl 4-methoxybenzenesulfonate | C20H15NO5S

3-Phenyl-1,2-benzoxazol-6-yl 4-methoxybenzenesulfonate

  • Molecular FormulaC20H15NO5S
  • Average mass381.402 Da
  • Monoisotopic mass381.067108 Da
  • ChemSpider ID21482312

More details:

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

3-Phenyl-1,2-benzoxazol-6-yl 4-methoxybenzenesulfonate [ACD/IUPAC Name]
3-Phenyl-1,2-benzoxazol-6-yl-4-methoxybenzolsulfonat [German] [ACD/IUPAC Name]
4-Méthoxybenzènesulfonate de 3-phényl-1,2-benzoxazol-6-yle [French] [ACD/IUPAC Name]
Benzenesulfonic acid, 4-methoxy-, 3-phenyl-1,2-benzisoxazol-6-yl ester [ACD/Index Name]
(3-phenyl-1,2-benzoxazol-6-yl) 4-methoxybenzenesulfonate
1144475-83-1 [RN]
4-Methoxy-benzenesulfonic acid 3-phenyl-benzo[d]isoxazol-6-yl ester

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 595.6±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 85.5±3.0 kJ/mol
    Flash Point: 314.0±30.1 °C
    Index of Refraction: 1.633
    Molar Refractivity: 100.9±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 4.75
    ACD/LogD (pH 5.5): 3.97
    ACD/BCF (pH 5.5): 611.84
    ACD/KOC (pH 5.5): 3437.79
    ACD/LogD (pH 7.4): 3.97
    ACD/BCF (pH 7.4): 611.84
    ACD/KOC (pH 7.4): 3437.79
    Polar Surface Area: 87 Å2
    Polarizability: 40.0±0.5 10-24cm3
    Surface Tension: 53.4±3.0 dyne/cm
    Molar Volume: 282.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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