ChemSpider 2D Image | 5-(3,4-Bis{[(4-methylphenyl)sulfonyl]amino}phenoxy)pentyl acetate | C27H32N2O7S2

5-(3,4-Bis{[(4-methylphenyl)sulfonyl]amino}phenoxy)pentyl acetate

  • Molecular FormulaC27H32N2O7S2
  • Average mass560.682 Da
  • Monoisotopic mass560.165100 Da
  • ChemSpider ID9759666

More details:

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

5-(3,4-Bis{[(4-methylphenyl)sulfonyl]amino}phenoxy)pentyl acetate [ACD/IUPAC Name]
5-(3,4-Bis{[(4-methylphenyl)sulfonyl]amino}phenoxy)pentyl-acetat [German] [ACD/IUPAC Name]
Acétate de 5-(3,4-bis{[(4-méthylphényl)sulfonyl]amino}phénoxy)pentyle [French] [ACD/IUPAC Name]
Benzenesulfonamide, N,N'-[4-[[5-(acetyloxy)pentyl]oxy]-1,2-phenylene]bis[4-methyl- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 702.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.8±3.0 kJ/mol
Flash Point: 378.7±35.7 °C
Index of Refraction: 1.602
Molar Refractivity: 146.4±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 5.86
ACD/LogD (pH 5.5): 5.32
ACD/BCF (pH 5.5): 6502.38
ACD/KOC (pH 5.5): 18642.35
ACD/LogD (pH 7.4): 5.20
ACD/BCF (pH 7.4): 4967.66
ACD/KOC (pH 7.4): 14242.32
Polar Surface Area: 145 Å2
Polarizability: 58.0±0.5 10-24cm3
Surface Tension: 55.8±3.0 dyne/cm
Molar Volume: 426.7±3.0 cm3

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