ChemSpider 2D Image | N-[2-(Butylamino)-2-oxo-1-phenylethyl]-N-phenyl-4-(1-pyrenyl)butanamide | C38H36N2O2

N-[2-(Butylamino)-2-oxo-1-phenylethyl]-N-phenyl-4-(1-pyrenyl)butanamide

  • Molecular FormulaC38H36N2O2
  • Average mass552.705 Da
  • Monoisotopic mass552.277649 Da
  • ChemSpider ID21106208

More details:






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

1-Pyrenebutanamide, N-[2-(butylamino)-2-oxo-1-phenylethyl]-N-phenyl- [ACD/Index Name]
N-[2-(Butylamino)-2-oxo-1-phenylethyl]-N-phenyl-4-(1-pyrenyl)butanamid [German] [ACD/IUPAC Name]
N-[2-(Butylamino)-2-oxo-1-phenylethyl]-N-phenyl-4-(1-pyrenyl)butanamide [ACD/IUPAC Name]
N-[2-(Butylamino)-2-oxo-1-phényléthyl]-N-phényl-4-(1-pyrényl)butanamide [French] [ACD/IUPAC Name]
N-[2-(Butylamino)-2-oxo-1-phenylethyl]-N-phenyl-4-(pyren-1-yl)butanamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 780.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.6±3.0 kJ/mol
Flash Point: 426.0±32.9 °C
Index of Refraction: 1.699
Molar Refractivity: 176.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 8.32
ACD/LogD (pH 5.5): 7.62
ACD/BCF (pH 5.5): 366466.25
ACD/KOC (pH 5.5): 334432.28
ACD/LogD (pH 7.4): 7.62
ACD/BCF (pH 7.4): 366467.06
ACD/KOC (pH 7.4): 334433.03
Polar Surface Area: 49 Å2
Polarizability: 70.0±0.5 10-24cm3
Surface Tension: 56.0±3.0 dyne/cm
Molar Volume: 457.2±3.0 cm3

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