ChemSpider 2D Image | 1-{2-[5-(4-Cyanophenyl)-1-benzofuran-2-yl]ethyl}-2-methylpyrrolidinium | C22H23N2O

1-{2-[5-(4-Cyanophenyl)-1-benzofuran-2-yl]ethyl}-2-methylpyrrolidinium

  • Molecular FormulaC22H23N2O
  • Average mass331.430 Da
  • Monoisotopic mass331.180481 Da
  • ChemSpider ID21219943

  • Charge - Charge

More details:

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

1-{2-[5-(4-Cyanophenyl)-1-benzofuran-2-yl]ethyl}-2-methylpyrrolidinium [ACD/IUPAC Name]
1-{2-[5-(4-Cyanophényl)-1-benzofuran-2-yl]éthyl}-2-méthylpyrrolidinium [French] [ACD/IUPAC Name]
1-{2-[5-(4-Cyanphenyl)-1-benzofuran-2-yl]ethyl}-2-methylpyrrolidinium [German] [ACD/IUPAC Name]
Pyrrolidinium, 1-[2-[5-(4-cyanophenyl)-2-benzofuranyl]ethyl]-2-methyl- [ACD/Index Name]

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

Density:
Boiling Point: 493.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.1±3.0 kJ/mol
Flash Point: 252.2±27.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.73
ACD/LogD (pH 5.5): 2.02
ACD/BCF (pH 5.5): 3.64
ACD/KOC (pH 5.5): 11.63
ACD/LogD (pH 7.4): 2.53
ACD/BCF (pH 7.4): 11.79
ACD/KOC (pH 7.4): 37.69
Polar Surface Area: 41 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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