ChemSpider 2D Image | ethyl 4-[(3-ethoxycarbonyl-2-hydroxy-1-naphthyl)methyl]-3-hydroxy-naphthalene-2-carboxylate | C27H24O6

ethyl 4-[(3-ethoxycarbonyl-2-hydroxy-1-naphthyl)methyl]-3-hydroxy-naphthalene-2-carboxylate

  • Molecular FormulaC27H24O6
  • Average mass444.476 Da
  • Monoisotopic mass444.157288 Da
  • ChemSpider ID21127497

More details:

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

4,4'-Méthylènebis(3-hydroxy-2-naphtoate) de diéthyle [French] [ACD/IUPAC Name]
Diethyl-4,4'-methylenbis(3-hydroxy-2-naphthoat) [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 621.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.4±3.0 kJ/mol
Flash Point: 209.3±25.0 °C
Index of Refraction: 1.669
Molar Refractivity: 127.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 7.76
ACD/LogD (pH 5.5): 6.95
ACD/BCF (pH 5.5): 112162.60
ACD/KOC (pH 5.5): 143281.75
ACD/LogD (pH 7.4): 6.93
ACD/BCF (pH 7.4): 107450.76
ACD/KOC (pH 7.4): 137262.61
Polar Surface Area: 93 Å2
Polarizability: 50.7±0.5 10-24cm3
Surface Tension: 57.9±3.0 dyne/cm
Molar Volume: 342.7±3.0 cm3

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