ChemSpider 2D Image | diketopyrrolopyrrole | C6H2N2O2

diketopyrrolopyrrole

  • Molecular FormulaC6H2N2O2
  • Average mass134.092 Da
  • Monoisotopic mass134.011627 Da
  • ChemSpider ID14112326

More details:

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

diketopyrrolopyrrole
Pyrrolo[3,2-b]pyrrol-2,3-dion [German] [ACD/IUPAC Name]
Pyrrolo[3,2-b]pyrrole-2,3-dione [ACD/Index Name] [ACD/IUPAC Name]
Pyrrolo[3,2-b]pyrrole-2,3-dione [French] [ACD/Index Name] [ACD/IUPAC Name]
diketo-pyrrolopyrrole

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

Density: 1.8±0.1 g/cm3
Boiling Point: 264.5±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 50.2±3.0 kJ/mol
Flash Point: 105.8±28.0 °C
Index of Refraction: 1.815
Molar Refractivity: 32.9±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -1.50
ACD/LogD (pH 5.5): -0.73
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.59
ACD/LogD (pH 7.4): -0.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.59
Polar Surface Area: 59 Å2
Polarizability: 13.0±0.5 10-24cm3
Surface Tension: 80.4±7.0 dyne/cm
Molar Volume: 75.9±7.0 cm3

Click to predict properties on the Chemicalize site


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