ChemSpider 2D Image | Diethyl 12-benzyl-6,6(5H)-tetraphenedicarboxylate | C31H28O4

Diethyl 12-benzyl-6,6(5H)-tetraphenedicarboxylate

  • Molecular FormulaC31H28O4
  • Average mass464.552 Da
  • Monoisotopic mass464.198761 Da
  • ChemSpider ID28415466

More details:

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

12-Benzyl-6,6(5H)-tétraphènedicarboxylate de diéthyle [French] [ACD/IUPAC Name]
Benz[a]anthracene-6,6(5H)-dicarboxylic acid, 12-(phenylmethyl)-, diethyl ester [ACD/Index Name]
Diethyl 12-benzyl-6,6(5H)-tetraphenedicarboxylate [ACD/IUPAC Name]
Diethyl-12-benzyl-6,6(5H)-tetraphendicarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 587.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.8±3.0 kJ/mol
Flash Point: 293.7±28.5 °C
Index of Refraction: 1.625
Molar Refractivity: 136.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 8.23
ACD/LogD (pH 5.5): 7.70
ACD/BCF (pH 5.5): 421667.81
ACD/KOC (pH 5.5): 369765.53
ACD/LogD (pH 7.4): 7.70
ACD/BCF (pH 7.4): 421667.81
ACD/KOC (pH 7.4): 369765.53
Polar Surface Area: 53 Å2
Polarizability: 54.2±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 386.3±3.0 cm3

Click to predict properties on the Chemicalize site


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