ChemSpider 2D Image | 3-{[(1E)-1-Phenyl-1-buten-3-yn-2-yl]oxy}-2-cyclopenten-1-one | C15H12O2

3-{[(1E)-1-Phenyl-1-buten-3-yn-2-yl]oxy}-2-cyclopenten-1-one

  • Molecular FormulaC15H12O2
  • Average mass224.255 Da
  • Monoisotopic mass224.083725 Da
  • ChemSpider ID30660298

  • Double-bond stereo - Double-bond stereo

More details:

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

2-Cyclopenten-1-one, 3-[[(1E)-1-(phenylmethylene)-2-propyn-1-yl]oxy]- [ACD/Index Name]
3-{[(1E)-1-Phenyl-1-buten-3-in-2-yl]oxy}-2-cyclopenten-1-on [German] [ACD/IUPAC Name]
3-{[(1E)-1-Phenyl-1-buten-3-yn-2-yl]oxy}-2-cyclopenten-1-one [ACD/IUPAC Name]
3-{[(1E)-1-Phényl-1-butén-3-yn-2-yl]oxy}-2-cyclopentén-1-one [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 363.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.0±3.0 kJ/mol
Flash Point: 164.3±21.4 °C
Index of Refraction: 1.591
Molar Refractivity: 65.4±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.47
ACD/LogD (pH 5.5): 2.68
ACD/BCF (pH 5.5): 64.60
ACD/KOC (pH 5.5): 687.64
ACD/LogD (pH 7.4): 2.68
ACD/BCF (pH 7.4): 64.60
ACD/KOC (pH 7.4): 687.64
Polar Surface Area: 26 Å2
Polarizability: 25.9±0.5 10-24cm3
Surface Tension: 47.2±5.0 dyne/cm
Molar Volume: 193.6±5.0 cm3

Click to predict properties on the Chemicalize site


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