ChemSpider 2D Image | Methyl 4-(4-oxo-4H-chromen-2-yl)benzoate | C17H12O4

Methyl 4-(4-oxo-4H-chromen-2-yl)benzoate

  • Molecular FormulaC17H12O4
  • Average mass280.275 Da
  • Monoisotopic mass280.073547 Da
  • ChemSpider ID22178266

More details:

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

4-(4-Oxo-4H-chromén-2-yl)benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-(4-oxo-4H-1-benzopyran-2-yl)-, methyl ester [ACD/Index Name]
Methyl 4-(4-oxo-4H-chromen-2-yl)benzoate [ACD/IUPAC Name]
Methyl-4-(4-oxo-4H-chromen-2-yl)benzoat [German] [ACD/IUPAC Name]
F08
Methyl-4-(4-oxo-4H-chromen-2-yl)benzoat

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

Density: 1.3±0.1 g/cm3
Boiling Point: 434.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.0±3.0 kJ/mol
Flash Point: 193.7±28.8 °C
Index of Refraction: 1.617
Molar Refractivity: 76.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.53
ACD/LogD (pH 5.5): 3.43
ACD/BCF (pH 5.5): 237.62
ACD/KOC (pH 5.5): 1746.88
ACD/LogD (pH 7.4): 3.43
ACD/BCF (pH 7.4): 237.62
ACD/KOC (pH 7.4): 1746.88
Polar Surface Area: 53 Å2
Polarizability: 30.1±0.5 10-24cm3
Surface Tension: 50.7±3.0 dyne/cm
Molar Volume: 217.2±3.0 cm3

Click to predict properties on the Chemicalize site


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