ChemSpider 2D Image | 2-[3-(4-Chlorophenyl)-2-oxopropyl]benzoic acid | C16H13ClO3

2-[3-(4-Chlorophenyl)-2-oxopropyl]benzoic acid

  • Molecular FormulaC16H13ClO3
  • Average mass288.726 Da
  • Monoisotopic mass288.055328 Da
  • ChemSpider ID24741024

More details:

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

2-[3-(4-Chlorophenyl)-2-oxopropyl]benzoic acid [ACD/IUPAC Name]
2-[3-(4-Chlorphenyl)-2-oxopropyl]benzoesäure [German] [ACD/IUPAC Name]
Acide 2-[3-(4-chlorophényl)-2-oxopropyl]benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-[3-(4-chlorophenyl)-2-oxopropyl]- [ACD/Index 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: 447.5±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 74.4±3.0 kJ/mol
Flash Point: 224.4±24.6 °C
Index of Refraction: 1.611
Molar Refractivity: 76.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.26
ACD/LogD (pH 5.5): 2.16
ACD/BCF (pH 5.5): 10.21
ACD/KOC (pH 5.5): 61.75
ACD/LogD (pH 7.4): 0.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.79
Polar Surface Area: 54 Å2
Polarizability: 30.4±0.5 10-24cm3
Surface Tension: 53.9±3.0 dyne/cm
Molar Volume: 221.1±3.0 cm3

Click to predict properties on the Chemicalize site


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