ChemSpider 2D Image | 3-[3-(2-Nitrophenoxy)-1-propyn-1-yl]-2,5-furandione | C13H7NO6

3-[3-(2-Nitrophenoxy)-1-propyn-1-yl]-2,5-furandione

  • Molecular FormulaC13H7NO6
  • Average mass273.198 Da
  • Monoisotopic mass273.027344 Da
  • ChemSpider ID87933309

More details:

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

2,5-Furandione, 3-[3-(2-nitrophenoxy)-1-propyn-1-yl]- [ACD/Index Name]
3-[3-(2-Nitrophenoxy)-1-propin-1-yl]-2,5-furandion [German] [ACD/IUPAC Name]
3-[3-(2-Nitrophenoxy)-1-propyn-1-yl]-2,5-furandione [ACD/IUPAC Name]
3-[3-(2-Nitrophénoxy)-1-propyn-1-yl]-2,5-furanedione [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 490.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.7±3.0 kJ/mol
Flash Point: 235.0±30.7 °C
Index of Refraction: 1.633
Molar Refractivity: 64.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.42
ACD/LogD (pH 5.5): 1.90
ACD/BCF (pH 5.5): 16.28
ACD/KOC (pH 5.5): 256.39
ACD/LogD (pH 7.4): 1.90
ACD/BCF (pH 7.4): 16.28
ACD/KOC (pH 7.4): 256.39
Polar Surface Area: 98 Å2
Polarizability: 25.6±0.5 10-24cm3
Surface Tension: 70.4±5.0 dyne/cm
Molar Volume: 180.9±5.0 cm3

Click to predict properties on the Chemicalize site


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