ChemSpider 2D Image | 1-[(4-Methylphenyl)sulfonyl]-1H-indole-2-carbaldehyde | C16H13NO3S

1-[(4-Methylphenyl)sulfonyl]-1H-indole-2-carbaldehyde

  • Molecular FormulaC16H13NO3S
  • Average mass299.344 Da
  • Monoisotopic mass299.061615 Da
  • ChemSpider ID23361073

More details:

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

1-[(4-Methylphenyl)sulfonyl]-1H-indol-2-carbaldehyd [German] [ACD/IUPAC Name]
1-[(4-Methylphenyl)sulfonyl]-1H-indole-2-carbaldehyde [ACD/IUPAC Name]
1-[(4-Méthylphényl)sulfonyl]-1H-indole-2-carbaldéhyde [French] [ACD/IUPAC Name]
146384-54-5 [RN]
1H-Indole-2-carboxaldehyde, 1-[(4-methylphenyl)sulfonyl]- [ACD/Index Name]
1-(4-methylbenzenesulfonyl)-1H-indole-2-carbaldehyde
1-(4-METHYLBENZENESULFONYL)INDOLE-2-CARBALDEHYDE
1-(4-methylphenyl)sulfonylindole-2-carbaldehyde
1-(p-toluenesulfonyl)-1H-indole-2-carboxyaldehyde
1-(Toluene-4-sulfonyl)-1H-indole-2-carbaldehyde
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 517.2±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 78.9±3.0 kJ/mol
    Flash Point: 266.6±30.7 °C
    Index of Refraction: 1.634
    Molar Refractivity: 83.0±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.59
    ACD/LogD (pH 5.5): 2.95
    ACD/BCF (pH 5.5): 102.83
    ACD/KOC (pH 5.5): 959.17
    ACD/LogD (pH 7.4): 2.95
    ACD/BCF (pH 7.4): 102.83
    ACD/KOC (pH 7.4): 959.17
    Polar Surface Area: 65 Å2
    Polarizability: 32.9±0.5 10-24cm3
    Surface Tension: 51.2±7.0 dyne/cm
    Molar Volume: 232.2±7.0 cm3

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