ChemSpider 2D Image | 7-(Phenylethynyl)-4H-chromen-4-one | C17H10O2

7-(Phenylethynyl)-4H-chromen-4-one

  • Molecular FormulaC17H10O2
  • Average mass246.260 Da
  • Monoisotopic mass246.068085 Da
  • ChemSpider ID22178812

More details:

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

4H-1-Benzopyran-4-one, 7-(2-phenylethynyl)- [ACD/Index Name]
7-(Phenylethinyl)-4H-chromen-4-on [German] [ACD/IUPAC Name]
7-(Phenylethynyl)-4H-chromen-4-one [ACD/IUPAC Name]
7-(Phényléthynyl)-4H-chromén-4-one [French] [ACD/IUPAC Name]
7-(2-phenylethynyl)-4H-chromen-4-one

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

Density: 1.3±0.1 g/cm3
Boiling Point: 419.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.4±3.0 kJ/mol
Flash Point: 197.2±22.3 °C
Index of Refraction: 1.675
Molar Refractivity: 72.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.94
ACD/LogD (pH 5.5): 3.79
ACD/BCF (pH 5.5): 446.57
ACD/KOC (pH 5.5): 2744.07
ACD/LogD (pH 7.4): 3.79
ACD/BCF (pH 7.4): 446.57
ACD/KOC (pH 7.4): 2744.07
Polar Surface Area: 26 Å2
Polarizability: 28.7±0.5 10-24cm3
Surface Tension: 59.8±5.0 dyne/cm
Molar Volume: 192.5±5.0 cm3

Click to predict properties on the Chemicalize site


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