ChemSpider 2D Image | [3-(4-Chlorophenyl)-3-oxo-1-phenylpropyl]malonic acid | C18H15ClO5

[3-(4-Chlorophenyl)-3-oxo-1-phenylpropyl]malonic acid

  • Molecular FormulaC18H15ClO5
  • Average mass346.762 Da
  • Monoisotopic mass346.060791 Da
  • ChemSpider ID28663045

More details:

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

[3-(4-Chlorophenyl)-3-oxo-1-phenylpropyl]malonic acid [ACD/IUPAC Name]
[3-(4-Chlorphenyl)-3-oxo-1-phenylpropyl]malonsäure [German] [ACD/IUPAC Name]
Acide [3-(4-chlorophényl)-3-oxo-1-phénylpropyl]malonique [French] [ACD/IUPAC Name]
Propanedioic acid, 2-[3-(4-chlorophenyl)-3-oxo-1-phenylpropyl]- [ACD/Index Name]
PS182

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

Density: 1.4±0.1 g/cm3
Boiling Point: 604.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.6±3.0 kJ/mol
Flash Point: 319.6±31.5 °C
Index of Refraction: 1.615
Molar Refractivity: 87.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.91
ACD/LogD (pH 5.5): 0.63
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.62
ACD/LogD (pH 7.4): -1.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 34.6±0.5 10-24cm3
Surface Tension: 61.2±3.0 dyne/cm
Molar Volume: 250.0±3.0 cm3

Click to predict properties on the Chemicalize site


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