ChemSpider 2D Image | Ethyl 3-bromo-4-{2-[(3-bromo-4-biphenylyl)oxy]acetoxy}benzoate | C23H18Br2O5

Ethyl 3-bromo-4-{2-[(3-bromo-4-biphenylyl)oxy]acetoxy}benzoate

  • Molecular FormulaC23H18Br2O5
  • Average mass534.194 Da
  • Monoisotopic mass531.952087 Da
  • ChemSpider ID12969889

More details:

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

3-Bromo-4-{2-[(3-bromo-4-biphénylyl)oxy]acétoxy}benzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-bromo-4-[[2-[(3-bromo[1,1'-biphenyl]-4-yl)oxy]acetyl]oxy]-, ethyl ester [ACD/Index Name]
Ethyl 3-bromo-4-{2-[(3-bromo-4-biphenylyl)oxy]acetoxy}benzoate [ACD/IUPAC Name]
Ethyl-3-brom-4-{2-[(3-brom-4-biphenylyl)oxy]acetoxy}benzoat [German] [ACD/IUPAC Name]
benzoic acid, 3-bromo-4-[[[(3-bromo[1,1'-biphenyl]-4-yl)oxy]acetyl]oxy]-, ethyl ester
ethyl 3-bromo-4-({[(3-bromo-4-biphenylyl)oxy]acetyl}oxy)benzoate

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

Density: 1.5±0.1 g/cm3
Boiling Point: 610.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.7±3.0 kJ/mol
Flash Point: 323.1±31.5 °C
Index of Refraction: 1.608
Molar Refractivity: 120.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 6.62
ACD/LogD (pH 5.5): 6.42
ACD/BCF (pH 5.5): 44432.89
ACD/KOC (pH 5.5): 73860.05
ACD/LogD (pH 7.4): 6.42
ACD/BCF (pH 7.4): 44432.89
ACD/KOC (pH 7.4): 73860.05
Polar Surface Area: 62 Å2
Polarizability: 47.7±0.5 10-24cm3
Surface Tension: 49.1±3.0 dyne/cm
Molar Volume: 347.5±3.0 cm3

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