ChemSpider 2D Image | 4,4'-{[3,6-Di(2-pyridinyl)-2,5-pyrazinediyl]di(E)-2,1-ethenediyl}bis(N,N-dipropylaniline) | C42H48N6

4,4'-{[3,6-Di(2-pyridinyl)-2,5-pyrazinediyl]di(E)-2,1-ethenediyl}bis(N,N-dipropylaniline)

  • Molecular FormulaC42H48N6
  • Average mass636.871 Da
  • Monoisotopic mass636.394043 Da
  • ChemSpider ID24528095
  • Double-bond stereo - Double-bond stereo


More details:






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

4,4'-{[3,6-Di(2-pyridinyl)-2,5-pyrazindiyl]di(E)-2,1-ethendiyl}bis(N,N-dipropylanilin) [German] [ACD/IUPAC Name]
4,4'-{[3,6-Di(2-pyridinyl)-2,5-pyrazinediyl]di(E)-2,1-ethenediyl}bis(N,N-dipropylaniline) [ACD/IUPAC Name]
4,4'-{[3,6-Di(2-pyridinyl)-2,5-pyrazinediyl]di(E)-2,1-éthènediyl}bis(N,N-dipropylaniline) [French] [ACD/IUPAC Name]
Benzenamine, 4,4'-[(3,6-di-2-pyridinyl-2,5-pyrazinediyl)di(E)-2,1-ethenediyl]bis[N,N-dipropyl- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 801.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 116.5±3.0 kJ/mol
Flash Point: 438.4±34.3 °C
Index of Refraction: 1.655
Molar Refractivity: 208.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 12.34
ACD/LogD (pH 5.5): 9.02
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1630736.38
ACD/LogD (pH 7.4): 9.18
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 2348190.25
Polar Surface Area: 58 Å2
Polarizability: 82.6±0.5 10-24cm3
Surface Tension: 51.8±3.0 dyne/cm
Molar Volume: 567.3±3.0 cm3

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