ChemSpider 2D Image | [Bis(4-fluorophenyl)methyl][2-oxo-2-(4-propyl-1-piperazinyl)ethyl]sulfoniumolate | C22H26F2N2O2S

[Bis(4-fluorophenyl)methyl][2-oxo-2-(4-propyl-1-piperazinyl)ethyl]sulfoniumolate

  • Molecular FormulaC22H26F2N2O2S
  • Average mass420.516 Da
  • Monoisotopic mass420.168304 Da
  • ChemSpider ID76812932

More details:

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

[Bis(4-fluorophenyl)methyl][2-oxo-2-(4-propyl-1-piperazinyl)ethyl]sulfoniumolate [ACD/IUPAC Name]
[Bis(4-fluorophényl)méthyl][2-oxo-2-(4-propyl-1-pipérazinyl)éthyl]sulfoniumolate [French] [ACD/IUPAC Name]
[Bis(4-fluorphenyl)methyl][2-oxo-2-(4-propyl-1-piperazinyl)ethyl]sulfoniumolat [German] [ACD/IUPAC Name]
Sulfonium, [bis(4-fluorophenyl)methyl]hydroxy[2-oxo-2-(4-propyl-1-piperazinyl)ethyl]-, inner salt [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.582
Molar Refractivity: 111.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 47 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 332.9±3.0 cm3

Click to predict properties on the Chemicalize site


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