ChemSpider 2D Image | 1,1'-{(5-Ethynyl-1,3-phenylene)bis[oxy-2,1-ethanediyloxy(1-oxo-3,1-propanediyl)oxy]}di(2,5-pyrrolidinedione) | C26H28N2O12

1,1'-{(5-Ethynyl-1,3-phenylene)bis[oxy-2,1-ethanediyloxy(1-oxo-3,1-propanediyl)oxy]}di(2,5-pyrrolidinedione)

  • Molecular FormulaC26H28N2O12
  • Average mass560.507 Da
  • Monoisotopic mass560.164246 Da
  • ChemSpider ID82952781

More details:

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

1,1'-{(5-Ethinyl-1,3-phenylen)bis[oxy-2,1-ethandiyloxy(1-oxo-3,1-propandiyl)oxy]}di(2,5-pyrrolidindion) [German] [ACD/IUPAC Name]
1,1'-{(5-Ethynyl-1,3-phenylene)bis[oxy-2,1-ethanediyloxy(1-oxo-3,1-propanediyl)oxy]}di(2,5-pyrrolidinedione) [ACD/IUPAC Name]
1,1'-{(5-Éthynyl-1,3-phénylène)bis[oxy-2,1-éthanediyloxy(1-oxo-3,1-propanediyl)oxy]}di(2,5-pyrrolidinedione) [French] [ACD/IUPAC Name]
2,5-Pyrrolidinedione, 1,1'-[(5-ethynyl-1,3-phenylene)bis[oxy-2,1-ethanediyloxy(1-oxo-3,1-propanediyl)oxy]]bis- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 704.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.1±3.0 kJ/mol
Flash Point: 379.8±35.7 °C
Index of Refraction: 1.588
Molar Refractivity: 132.0±0.4 cm3
#H bond acceptors: 14
#H bond donors: 0
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 2
ACD/LogP: -1.99
ACD/LogD (pH 5.5): -0.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.68
ACD/LogD (pH 7.4): -0.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.68
Polar Surface Area: 164 Å2
Polarizability: 52.3±0.5 10-24cm3
Surface Tension: 68.3±5.0 dyne/cm
Molar Volume: 392.3±5.0 cm3

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