ChemSpider 2D Image | 3,3'-{1,4-Phenylenebis[(E)methylylidene(E)azanylylidene]}bis(N,N-diethyl-6-methylbenzenesulfonamide) | C30H38N4O4S2

3,3'-{1,4-Phenylenebis[(E)methylylidene(E)azanylylidene]}bis(N,N-diethyl-6-methylbenzenesulfonamide)

  • Molecular FormulaC30H38N4O4S2
  • Average mass582.777 Da
  • Monoisotopic mass582.233459 Da
  • ChemSpider ID2923851
  • Double-bond stereo - Double-bond stereo


More details:






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

3,3'-{1,4-Phenylenbis[(E)methylyliden(E)azanylyliden]}bis(N,N-diethyl-6-methylbenzolsulfonamid) [German] [ACD/IUPAC Name]
3,3'-{1,4-Phenylenebis[(E)methylylidene(E)azanylylidene]}bis(N,N-diethyl-6-methylbenzenesulfonamide) [ACD/IUPAC Name]
3,3'-{1,4-Phénylènebis[(E)méthylylidène(E)azanylylidène]}bis(N,N-diéthyl-6-méthylbenzènesulfonamide) [French] [ACD/IUPAC Name]
Benzenesulfonamide, 3,3'-[1,4-phenylenebis[(E)methylidynenitrilo]]bis[N,N-diethyl-6-methyl- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 746.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.8±3.0 kJ/mol
Flash Point: 405.2±35.7 °C
Index of Refraction: 1.583
Molar Refractivity: 165.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 6.12
ACD/LogD (pH 5.5): 6.02
ACD/BCF (pH 5.5): 22103.67
ACD/KOC (pH 5.5): 44796.46
ACD/LogD (pH 7.4): 6.02
ACD/BCF (pH 7.4): 22123.14
ACD/KOC (pH 7.4): 44835.92
Polar Surface Area: 116 Å2
Polarizability: 65.6±0.5 10-24cm3
Surface Tension: 43.6±7.0 dyne/cm
Molar Volume: 495.6±7.0 cm3

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