ChemSpider 2D Image | Methyl 4-(1-pyrenylcarbonyl)benzoate | C25H16O3

Methyl 4-(1-pyrenylcarbonyl)benzoate

  • Molecular FormulaC25H16O3
  • Average mass364.393 Da
  • Monoisotopic mass364.109955 Da
  • ChemSpider ID28690508

More details:

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

4-(1-Pyrénylcarbonyl)benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-(1-pyrenylcarbonyl)-, methyl ester [ACD/Index Name]
Methyl 4-(1-pyrenylcarbonyl)benzoate [ACD/IUPAC Name]
Methyl-4-(1-pyrenylcarbonyl)benzoat [German] [ACD/IUPAC Name]
88475-90-5 [RN]
Methyl 4-(pyrene-1-carbonyl)benzoate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 578.6±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.6±3.0 kJ/mol
Flash Point: 253.9±25.4 °C
Index of Refraction: 1.757
Molar Refractivity: 114.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 6.54
ACD/LogD (pH 5.5): 5.59
ACD/BCF (pH 5.5): 10344.68
ACD/KOC (pH 5.5): 26020.98
ACD/LogD (pH 7.4): 5.59
ACD/BCF (pH 7.4): 10344.68
ACD/KOC (pH 7.4): 26020.98
Polar Surface Area: 43 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 60.2±3.0 dyne/cm
Molar Volume: 278.0±3.0 cm3

Click to predict properties on the Chemicalize site


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