ChemSpider 2D Image | 4-{[2-(Benzoyloxy)ethoxy]carbonyl}benzoic acid | C17H14O6

4-{[2-(Benzoyloxy)ethoxy]carbonyl}benzoic acid

  • Molecular FormulaC17H14O6
  • Average mass314.289 Da
  • Monoisotopic mass314.079041 Da
  • ChemSpider ID95544266

More details:

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

1,4-Benzenedicarboxylic acid, mono[2-(benzoyloxy)ethyl] ester [ACD/Index Name]
4-{[2-(Benzoyloxy)ethoxy]carbonyl}benzoesäure [German] [ACD/IUPAC Name]
4-{[2-(Benzoyloxy)ethoxy]carbonyl}benzoic acid [ACD/IUPAC Name]
Acide 4-{[2-(benzoyloxy)éthoxy]carbonyl}benzoïque [French] [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: 517.8±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.2±3.0 kJ/mol
Flash Point: 191.3±19.4 °C
Index of Refraction: 1.594
Molar Refractivity: 80.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.59
ACD/LogD (pH 5.5): 2.22
ACD/BCF (pH 5.5): 10.86
ACD/KOC (pH 5.5): 60.50
ACD/LogD (pH 7.4): 0.95
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.23
Polar Surface Area: 90 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 56.5±3.0 dyne/cm
Molar Volume: 238.6±3.0 cm3

Click to predict properties on the Chemicalize site


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