ChemSpider 2D Image | N-[3,5-Bis(trifluoromethyl)phenyl]-1,3-dioxo-2-(2-pyridinylmethyl)-5-isoindolinecarboxamide | C23H13F6N3O3

N-[3,5-Bis(trifluoromethyl)phenyl]-1,3-dioxo-2-(2-pyridinylmethyl)-5-isoindolinecarboxamide

  • Molecular FormulaC23H13F6N3O3
  • Average mass493.358 Da
  • Monoisotopic mass493.086121 Da
  • ChemSpider ID67085452

More details:

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

1H-Isoindole-5-carboxamide, N-[3,5-bis(trifluoromethyl)phenyl]-2,3-dihydro-1,3-dioxo-2-(2-pyridinylmethyl)- [ACD/Index Name]
N-[3,5-Bis(trifluormethyl)phenyl]-1,3-dioxo-2-(2-pyridinylmethyl)-5-isoindolincarboxamid [German] [ACD/IUPAC Name]
N-[3,5-Bis(trifluoromethyl)phenyl]-1,3-dioxo-2-(2-pyridinylmethyl)-5-isoindolinecarboxamide [ACD/IUPAC Name]
N-[3,5-Bis(trifluorométhyl)phényl]-1,3-dioxo-2-(2-pyridinylméthyl)-5-isoindolinecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 488.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.4±3.0 kJ/mol
Flash Point: 248.9±28.7 °C
Index of Refraction: 1.600
Molar Refractivity: 109.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.22
ACD/LogD (pH 5.5): 4.71
ACD/BCF (pH 5.5): 2202.77
ACD/KOC (pH 5.5): 8496.97
ACD/LogD (pH 7.4): 4.72
ACD/BCF (pH 7.4): 2296.74
ACD/KOC (pH 7.4): 8859.45
Polar Surface Area: 79 Å2
Polarizability: 43.4±0.5 10-24cm3
Surface Tension: 54.2±3.0 dyne/cm
Molar Volume: 320.0±3.0 cm3

Click to predict properties on the Chemicalize site


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