ChemSpider 2D Image | 4-{[4-(Hexadecyloxy)benzoyl]oxy}benzoic acid | C30H42O5

4-{[4-(Hexadecyloxy)benzoyl]oxy}benzoic acid

  • Molecular FormulaC30H42O5
  • Average mass482.651 Da
  • Monoisotopic mass482.303223 Da
  • ChemSpider ID35251901

More details:

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

4-{[4-(Hexadecyloxy)benzoyl]oxy}benzoesäure [German] [ACD/IUPAC Name]
4-{[4-(Hexadecyloxy)benzoyl]oxy}benzoic acid [ACD/IUPAC Name]
Acide 4-{[4-(hexadécyloxy)benzoyl]oxy}benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-(hexadecyloxy)-, 4-carboxyphenyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 616.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.1±3.0 kJ/mol
Flash Point: 193.1±20.8 °C
Index of Refraction: 1.529
Molar Refractivity: 141.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 1
ACD/LogP: 11.65
ACD/LogD (pH 5.5): 9.44
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 672177.75
ACD/LogD (pH 7.4): 7.98
ACD/BCF (pH 7.4): 134158.98
ACD/KOC (pH 7.4): 23560.28
Polar Surface Area: 73 Å2
Polarizability: 55.9±0.5 10-24cm3
Surface Tension: 41.6±3.0 dyne/cm
Molar Volume: 457.0±3.0 cm3

Click to predict properties on the Chemicalize site


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