ChemSpider 2D Image | (7-Hydroxy-2-oxo-2H-chromen-4-yl)methyl 1-(4-fluorobenzoyl)-4-piperidinecarboxylate | C23H20FNO6

(7-Hydroxy-2-oxo-2H-chromen-4-yl)methyl 1-(4-fluorobenzoyl)-4-piperidinecarboxylate

  • Molecular FormulaC23H20FNO6
  • Average mass425.406 Da
  • Monoisotopic mass425.127472 Da
  • ChemSpider ID22566045

More details:

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

(7-Hydroxy-2-oxo-2H-chromen-4-yl)methyl 1-(4-fluorobenzoyl)-4-piperidinecarboxylate [ACD/IUPAC Name]
(7-Hydroxy-2-oxo-2H-chromen-4-yl)methyl-1-(4-fluorbenzoyl)-4-piperidincarboxylat [German] [ACD/IUPAC Name]
1-(4-Fluorobenzoyl)-4-pipéridinecarboxylate de (7-hydroxy-2-oxo-2H-chromén-4-yl)méthyle [French] [ACD/IUPAC Name]
4-Piperidinecarboxylic acid, 1-(4-fluorobenzoyl)-, (7-hydroxy-2-oxo-2H-1-benzopyran-4-yl)methyl ester [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 656.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 100.1±3.0 kJ/mol
Flash Point: 350.5±31.5 °C
Index of Refraction: 1.616
Molar Refractivity: 106.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.91
ACD/LogD (pH 5.5): 2.83
ACD/BCF (pH 5.5): 83.81
ACD/KOC (pH 5.5): 827.07
ACD/LogD (pH 7.4): 2.66
ACD/BCF (pH 7.4): 56.24
ACD/KOC (pH 7.4): 554.97
Polar Surface Area: 93 Å2
Polarizability: 42.4±0.5 10-24cm3
Surface Tension: 58.1±3.0 dyne/cm
Molar Volume: 305.9±3.0 cm3

Click to predict properties on the Chemicalize site


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