ChemSpider 2D Image | N-(1,1-Dioxidotetrahydro-3-thiophenyl)-2-[(1-hydroxy-7-methoxy-9-oxo-9H-xanthen-3-yl)oxy]acetamide | C20H19NO8S

N-(1,1-Dioxidotetrahydro-3-thiophenyl)-2-[(1-hydroxy-7-methoxy-9-oxo-9H-xanthen-3-yl)oxy]acetamide

  • Molecular FormulaC20H19NO8S
  • Average mass433.432 Da
  • Monoisotopic mass433.083130 Da
  • ChemSpider ID21631673

More details:

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

Acetamide, 2-[(1-hydroxy-7-methoxy-9-oxo-9H-xanthen-3-yl)oxy]-N-(tetrahydro-1,1-dioxido-3-thienyl)- [ACD/Index Name]
N-(1,1-Dioxidotetrahydro-3-thiophenyl)-2-[(1-hydroxy-7-methoxy-9-oxo-9H-xanthen-3-yl)oxy]acetamid [German] [ACD/IUPAC Name]
N-(1,1-Dioxidotetrahydro-3-thiophenyl)-2-[(1-hydroxy-7-methoxy-9-oxo-9H-xanthen-3-yl)oxy]acetamide [ACD/IUPAC Name]
N-(1,1-Dioxydotétrahydro-3-thiophényl)-2-[(1-hydroxy-7-méthoxy-9-oxo-9H-xanthén-3-yl)oxy]acétamide [French] [ACD/IUPAC Name]
929860-91-3 [RN]
N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-[(1-hydroxy-7-methoxy-9-oxo-9H-xanthen-3-yl)oxy]acetamide
N-(1,1-Dioxo-tetrahydro-1λ*6*-thiophen-3-yl)-2-(1-hydroxy-7-methoxy-9-oxo-9H-xanthen-3-yloxy)-acetamide
N-(1,1-dioxothiolan-3-yl)-2-(1-hydroxy-7-methoxy-9-oxoxanthen-3-yl)oxyacetamide

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 822.2±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.1 mmHg at 25°C
    Enthalpy of Vaporization: 123.6±3.0 kJ/mol
    Flash Point: 451.1±34.3 °C
    Index of Refraction: 1.670
    Molar Refractivity: 103.8±0.4 cm3
    #H bond acceptors: 9
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 0.38
    ACD/LogD (pH 5.5): 1.24
    ACD/BCF (pH 5.5): 5.01
    ACD/KOC (pH 5.5): 107.91
    ACD/LogD (pH 7.4): 0.39
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 15.44
    Polar Surface Area: 137 Å2
    Polarizability: 41.2±0.5 10-24cm3
    Surface Tension: 77.4±5.0 dyne/cm
    Molar Volume: 277.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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