ChemSpider 2D Image | 3-[1-(2-Furyl)-3-oxobutyl]-2-oxo-2H-chromen-4-olate | C17H13O5

3-[1-(2-Furyl)-3-oxobutyl]-2-oxo-2H-chromen-4-olate

  • Molecular FormulaC17H13O5
  • Average mass297.283 Da
  • Monoisotopic mass297.076843 Da
  • ChemSpider ID95616643

  • Charge - Charge

More details:

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

2H-1-Benzopyran-2-one, 3-[1-(2-furanyl)-3-oxobutyl]-4-hydroxy-, ion(1-) [ACD/Index Name]
3-[1-(2-Furyl)-3-oxobutyl]-2-oxo-2H-chromen-4-olat [German] [ACD/IUPAC Name]
3-[1-(2-Furyl)-3-oxobutyl]-2-oxo-2H-chromen-4-olate [ACD/IUPAC Name]
3-[1-(2-Furyl)-3-oxobutyl]-2-oxo-2H-chromén-4-olate [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 475.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.9±3.0 kJ/mol
Flash Point: 241.5±28.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.58
ACD/LogD (pH 5.5): 1.49
ACD/BCF (pH 5.5): 4.48
ACD/KOC (pH 5.5): 51.56
ACD/LogD (pH 7.4): -0.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 80 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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