ChemSpider 2D Image | 3-(4-METHYLBENZOYL)-1-(4-METHYLBENZENESULFONYL)-1H-PYRROLE | C19H17NO3S

3-(4-METHYLBENZOYL)-1-(4-METHYLBENZENESULFONYL)-1H-PYRROLE

  • Molecular FormulaC19H17NO3S
  • Average mass339.408 Da
  • Monoisotopic mass339.092926 Da
  • ChemSpider ID30782788

More details:

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

(4-Methylphenyl){1-[(4-methylphenyl)sulfonyl]-1H-pyrrol-3-yl}methanon [German] [ACD/IUPAC Name]
(4-Methylphenyl){1-[(4-methylphenyl)sulfonyl]-1H-pyrrol-3-yl}methanone [ACD/IUPAC Name]
(4-Méthylphényl){1-[(4-méthylphényl)sulfonyl]-1H-pyrrol-3-yl}méthanone [French] [ACD/IUPAC Name]
1393442-27-7 [RN]
3-(4-METHYLBENZOYL)-1-(4-METHYLBENZENESULFONYL)-1H-PYRROLE
Methanone, (4-methylphenyl)[1-[(4-methylphenyl)sulfonyl]-1H-pyrrol-3-yl]- [ACD/Index Name]
[1393442-27-7] [RN]
3-(4-METHYLBENZOYL)-1-(4-METHYLBENZENESULFONYL)PYRROLE
3-(4-Methylphenyl)carbonyl-1-tosylpyrrole
HC-3820
More...

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 542.3±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 82.0±3.0 kJ/mol
    Flash Point: 281.8±30.7 °C
    Index of Refraction: 1.608
    Molar Refractivity: 96.7±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.15
    ACD/LogD (pH 5.5): 3.45
    ACD/BCF (pH 5.5): 247.33
    ACD/KOC (pH 5.5): 1797.68
    ACD/LogD (pH 7.4): 3.45
    ACD/BCF (pH 7.4): 247.33
    ACD/KOC (pH 7.4): 1797.68
    Polar Surface Area: 65 Å2
    Polarizability: 38.3±0.5 10-24cm3
    Surface Tension: 46.4±7.0 dyne/cm
    Molar Volume: 279.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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