ChemSpider 2D Image | 1-(4-Chlorophenyl)-4-phenyl-1,4-butanedione | C16H13ClO2

1-(4-Chlorophenyl)-4-phenyl-1,4-butanedione

  • Molecular FormulaC16H13ClO2
  • Average mass272.726 Da
  • Monoisotopic mass272.060394 Da
  • ChemSpider ID21514190

More details:

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

1-(4-Chlorophenyl)-4-phenyl-1,4-butanedione [ACD/IUPAC Name]
1-(4-Chlorophényl)-4-phényl-1,4-butanedione [French] [ACD/IUPAC Name]
1-(4-Chloro-phenyl)-4-phenyl-butane -1,4-dione
1-(4-Chloro-phenyl)-4-phenyl-butane; -1,4-dione
1-(4-Chlorophenyl)-4-phenylbutane-1,4-dione
1-(4-Chlorphenyl)-4-phenyl-1,4-butandion [German] [ACD/IUPAC Name]
1,4-Butanedione, 1-(4-chlorophenyl)-4-phenyl- [ACD/Index Name]
60721-33-7 [RN]
1-(4-Chloro-phenyl)-4-phenyl-butane
1-(4-chlorophenyl)-4-phenyl-butane-1,4-dione
More...

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

Density: 1.2±0.1 g/cm3
Boiling Point: 439.2±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.6±3.0 kJ/mol
Flash Point: 185.2±23.7 °C
Index of Refraction: 1.584
Molar Refractivity: 75.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.96
ACD/LogD (pH 5.5): 3.76
ACD/BCF (pH 5.5): 427.00
ACD/KOC (pH 5.5): 2657.44
ACD/LogD (pH 7.4): 3.76
ACD/BCF (pH 7.4): 427.00
ACD/KOC (pH 7.4): 2657.44
Polar Surface Area: 34 Å2
Polarizability: 29.9±0.5 10-24cm3
Surface Tension: 46.6±3.0 dyne/cm
Molar Volume: 225.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement