ChemSpider 2D Image | 4-Hydroxy-3-[(1Z)-3-oxo-1-phenyl-1-buten-1-yl]-2H-chromen-2-one | C19H14O4

4-Hydroxy-3-[(1Z)-3-oxo-1-phenyl-1-buten-1-yl]-2H-chromen-2-one

  • Molecular FormulaC19H14O4
  • Average mass306.312 Da
  • Monoisotopic mass306.089203 Da
  • ChemSpider ID57470284

  • Double-bond stereo - Double-bond stereo

More details:

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

2H-1-Benzopyran-2-one, 4-hydroxy-3-[(1Z)-3-oxo-1-phenyl-1-buten-1-yl]- [ACD/Index Name]
4-Hydroxy-3-[(1Z)-3-oxo-1-phenyl-1-buten-1-yl]-2H-chromen-2-on [German] [ACD/IUPAC Name]
4-Hydroxy-3-[(1Z)-3-oxo-1-phenyl-1-buten-1-yl]-2H-chromen-2-one [ACD/IUPAC Name]
4-Hydroxy-3-[(1Z)-3-oxo-1-phényl-1-butén-1-yl]-2H-chromén-2-one [French] [ACD/IUPAC Name]
2H-1-BENZOPYRAN-2-ONE, 4-HYDROXY-3-(3-OXO-1-PHENYL-1-BUTENYL)-, (Z)-

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

Density: 1.3±0.1 g/cm3
Boiling Point: 528.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.5±3.0 kJ/mol
Flash Point: 195.3±23.6 °C
Index of Refraction: 1.659
Molar Refractivity: 84.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.85
ACD/LogD (pH 5.5): 2.03
ACD/BCF (pH 5.5): 11.56
ACD/KOC (pH 5.5): 101.63
ACD/LogD (pH 7.4): 0.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.75
Polar Surface Area: 64 Å2
Polarizability: 33.6±0.5 10-24cm3
Surface Tension: 59.3±3.0 dyne/cm
Molar Volume: 230.0±3.0 cm3

Click to predict properties on the Chemicalize site


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