Found 194 results

Search term: MF = 'C_{13}H_{11}NO_{6}S'
ChemSpider 2D Image | 2-(1,1-Dioxidotetrahydro-3-thiophenyl)-1,3-dioxo-5-isoindolinecarboxylic acid | C13H11NO6S

2-(1,1-Dioxidotetrahydro-3-thiophenyl)-1,3-dioxo-5-isoindolinecarboxylic acid

  • Molecular FormulaC13H11NO6S
  • Average mass309.294 Da
  • Monoisotopic mass309.030701 Da
  • ChemSpider ID23368731

More details:

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

1097046-53-1 [RN]
1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-2-(tetrahydro-1,1-dioxido-3-thienyl)- [ACD/Index Name]
2-(1,1-Dioxidotetrahydro-3-thiophenyl)-1,3-dioxo-5-isoindolincarbonsäure [German] [ACD/IUPAC Name]
2-(1,1-Dioxidotetrahydro-3-thiophenyl)-1,3-dioxo-5-isoindolinecarboxylic acid [ACD/IUPAC Name]
2-(1,1-dioxidotetrahydrothiophen-3-yl)-1,3-dioxoisoindoline-5-carboxylic acid
2-(1,1-dioxo-1λ6-thiolan-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
Acide 2-(1,1-dioxydotétrahydro-3-thiophényl)-1,3-dioxo-5-isoindolinecarboxylique [French] [ACD/IUPAC Name]
2-(1,1-dioxidotetrahydrothiophen-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
2-(1,1-dioxo-1??-thiolan-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
2-(1,1-dioxo-1λ6-thiolan-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.7±0.1 g/cm3
    Boiling Point: 642.9±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.0 mmHg at 25°C
    Enthalpy of Vaporization: 99.7±3.0 kJ/mol
    Flash Point: 342.6±30.1 °C
    Index of Refraction: 1.681
    Molar Refractivity: 69.6±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.12
    ACD/LogD (pH 5.5): -1.59
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.54
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 117 Å2
    Polarizability: 27.6±0.5 10-24cm3
    Surface Tension: 84.5±3.0 dyne/cm
    Molar Volume: 184.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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