ChemSpider 2D Image | N-[(1E)-2-Bromo-1,3-butadien-1-yl]-4-methyl-N-(2-{[(4-methylphenyl)sulfonyl]amino}phenyl)benzenesulfonamide | C24H23BrN2O4S2

N-[(1E)-2-Bromo-1,3-butadien-1-yl]-4-methyl-N-(2-{[(4-methylphenyl)sulfonyl]amino}phenyl)benzenesulfonamide

  • Molecular FormulaC24H23BrN2O4S2
  • Average mass547.484 Da
  • Monoisotopic mass546.028259 Da
  • ChemSpider ID30658722

  • Double-bond stereo - Double-bond stereo

More details:

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

Benzenesulfonamide, N-[(1E)-2-bromo-1,3-butadien-1-yl]-4-methyl-N-[2-[[(4-methylphenyl)sulfonyl]amino]phenyl]- [ACD/Index Name]
N-[(1E)-2-Brom-1,3-butadien-1-yl]-4-methyl-N-(2-{[(4-methylphenyl)sulfonyl]amino}phenyl)benzolsulfonamid [German] [ACD/IUPAC Name]
N-[(1E)-2-Bromo-1,3-butadien-1-yl]-4-methyl-N-(2-{[(4-methylphenyl)sulfonyl]amino}phenyl)benzenesulfonamide [ACD/IUPAC Name]
N-[(1E)-2-Bromo-1,3-butadién-1-yl]-4-méthyl-N-(2-{[(4-méthylphényl)sulfonyl]amino}phényl)benzènesulfonamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 646.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.4±3.0 kJ/mol
Flash Point: 344.9±34.3 °C
Index of Refraction: 1.658
Molar Refractivity: 136.3±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.24
ACD/LogD (pH 5.5): 4.98
ACD/BCF (pH 5.5): 3609.17
ACD/KOC (pH 5.5): 12234.71
ACD/LogD (pH 7.4): 4.89
ACD/BCF (pH 7.4): 2891.38
ACD/KOC (pH 7.4): 9801.49
Polar Surface Area: 100 Å2
Polarizability: 54.0±0.5 10-24cm3
Surface Tension: 59.2±3.0 dyne/cm
Molar Volume: 370.0±3.0 cm3

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