ChemSpider 2D Image | 3-(4-Biphenylyl)-1-[2-(4-chlorophenyl)ethyl]-4-{[4-(2-methyl-2-propanyl)phenyl]amino}-1H-pyrrole-2,5-dione | C34H31ClN2O2

3-(4-Biphenylyl)-1-[2-(4-chlorophenyl)ethyl]-4-{[4-(2-methyl-2-propanyl)phenyl]amino}-1H-pyrrole-2,5-dione

  • Molecular FormulaC34H31ClN2O2
  • Average mass535.075 Da
  • Monoisotopic mass534.207397 Da
  • ChemSpider ID125648786

More details:

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

1H-Pyrrole-2,5-dione, 3-[1,1'-biphenyl]-4-yl-1-[2-(4-chlorophenyl)ethyl]-4-[[4-(1,1-dimethylethyl)phenyl]amino]- [ACD/Index Name]
3-(4-Biphenylyl)-1-[2-(4-chlorophenyl)ethyl]-4-{[4-(2-methyl-2-propanyl)phenyl]amino}-1H-pyrrole-2,5-dione [ACD/IUPAC Name]
3-(4-Biphénylyl)-1-[2-(4-chlorophényl)éthyl]-4-{[4-(2-méthyl-2-propanyl)phényl]amino}-1H-pyrrole-2,5-dione [French] [ACD/IUPAC Name]
3-(4-Biphenylyl)-1-[2-(4-chlorphenyl)ethyl]-4-{[4-(2-methyl-2-propanyl)phenyl]amino}-1H-pyrrol-2,5-dion [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 676.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.3±3.0 kJ/mol
Flash Point: 362.7±31.5 °C
Index of Refraction: 1.646
Molar Refractivity: 157.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 8.83
ACD/LogD (pH 5.5): 7.72
ACD/BCF (pH 5.5): 429877.44
ACD/KOC (pH 5.5): 374904.16
ACD/LogD (pH 7.4): 7.72
ACD/BCF (pH 7.4): 429877.44
ACD/KOC (pH 7.4): 374904.16
Polar Surface Area: 49 Å2
Polarizability: 62.3±0.5 10-24cm3
Surface Tension: 53.4±3.0 dyne/cm
Molar Volume: 433.4±3.0 cm3

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