ChemSpider 2D Image | 3-(3-Chlorophenyl)-1,5-bis(4-nitrophenyl)-1,5-pentanedione | C23H17ClN2O6

3-(3-Chlorophenyl)-1,5-bis(4-nitrophenyl)-1,5-pentanedione

  • Molecular FormulaC23H17ClN2O6
  • Average mass452.844 Da
  • Monoisotopic mass452.077515 Da
  • ChemSpider ID21128206

More details:

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

1,5-Pentanedione, 3-(3-chlorophenyl)-1,5-bis(4-nitrophenyl)- [ACD/Index Name]
3-(3-Chlorophenyl)-1,5-bis(4-nitrophenyl)-1,5-pentanedione [ACD/IUPAC Name]
3-(3-Chlorophényl)-1,5-bis(4-nitrophényl)-1,5-pentanedione [French] [ACD/IUPAC Name]
3-(3-Chlorphenyl)-1,5-bis(4-nitrophenyl)-1,5-pentandion [German] [ACD/IUPAC Name]
3-(3-Chlorophenyl)-1,5-bis(4-nitrophenyl)pentane-1,5-dione
918152-59-7 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 656.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.6±3.0 kJ/mol
Flash Point: 350.5±31.5 °C
Index of Refraction: 1.639
Molar Refractivity: 117.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 5.35
ACD/LogD (pH 5.5): 4.71
ACD/BCF (pH 5.5): 2231.72
ACD/KOC (pH 5.5): 8680.66
ACD/LogD (pH 7.4): 4.71
ACD/BCF (pH 7.4): 2231.72
ACD/KOC (pH 7.4): 8680.66
Polar Surface Area: 126 Å2
Polarizability: 46.6±0.5 10-24cm3
Surface Tension: 60.0±3.0 dyne/cm
Molar Volume: 327.0±3.0 cm3

Click to predict properties on the Chemicalize site


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