ChemSpider 2D Image | 1,2-Bis[5-(2-ethylhexyl)-2-thienyl]-1,2-ethanedione | C26H38O2S2

1,2-Bis[5-(2-ethylhexyl)-2-thienyl]-1,2-ethanedione

  • Molecular FormulaC26H38O2S2
  • Average mass446.709 Da
  • Monoisotopic mass446.231323 Da
  • ChemSpider ID29545305

More details:






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

1,2-Bis[5-(2-ethylhexyl)-2-thienyl]-1,2-ethandion [German] [ACD/IUPAC Name]
1,2-Bis[5-(2-ethylhexyl)-2-thienyl]-1,2-ethanedione [ACD/IUPAC Name]
1,2-Bis[5-(2-éthylhexyl)-2-thiényl]-1,2-éthanedione [French] [ACD/IUPAC Name]
1,2-Ethanedione, 1,2-bis[5-(2-ethylhexyl)-2-thienyl]- [ACD/Index Name]
1,2-bis[5-(2-ethylhexyl)thien-2-yl]ethane-1,2-dione

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

Density: 1.1±0.1 g/cm3
Boiling Point: 556.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.8±3.0 kJ/mol
Flash Point: 290.3±30.1 °C
Index of Refraction: 1.538
Molar Refractivity: 132.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 10.58
ACD/LogD (pH 5.5): 9.42
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 3164149.75
ACD/LogD (pH 7.4): 9.42
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 3164149.75
Polar Surface Area: 91 Å2
Polarizability: 52.6±0.5 10-24cm3
Surface Tension: 39.9±3.0 dyne/cm
Molar Volume: 423.8±3.0 cm3

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