ChemSpider 2D Image | Methyl 2-[(6-hexyl-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]propanoate | C25H28O5

Methyl 2-[(6-hexyl-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]propanoate

  • Molecular FormulaC25H28O5
  • Average mass408.487 Da
  • Monoisotopic mass408.193665 Da
  • ChemSpider ID21504651

More details:

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

2-[(6-Hexyl-2-oxo-4-phényl-2H-chromén-7-yl)oxy]propanoate de méthyle [French] [ACD/IUPAC Name]
Methyl 2-[(6-hexyl-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]propanoate [ACD/IUPAC Name]
Methyl-2-[(6-hexyl-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]propanoat [German] [ACD/IUPAC Name]
Propanoic acid, 2-[(6-hexyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]-, methyl ester [ACD/Index Name]
2-(6-Hexyl-2-oxo-4-phenyl-2H-chromen-7-yloxy)-propionic acid methyl ester
405908-06-7 [RN]
methyl 2-((6-hexyl-2-oxo-4-phenyl-2H-chromen-7-yl)oxy)propanoate
methyl 2-(6-hexyl-2-oxo-4-phenylchromen-7-yloxy)propanoate

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

Density: 1.1±0.1 g/cm3
Boiling Point: 546.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.5±3.0 kJ/mol
Flash Point: 234.9±30.2 °C
Index of Refraction: 1.558
Molar Refractivity: 114.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 6.72
ACD/LogD (pH 5.5): 6.39
ACD/BCF (pH 5.5): 42233.78
ACD/KOC (pH 5.5): 71224.62
ACD/LogD (pH 7.4): 6.39
ACD/BCF (pH 7.4): 42233.78
ACD/KOC (pH 7.4): 71224.62
Polar Surface Area: 62 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 44.2±3.0 dyne/cm
Molar Volume: 355.5±3.0 cm3

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