ChemSpider 2D Image | 1-(4-Fluorophenyl)-4-[4-hydroxy-4-(4-iodophenyl)-1-piperidinyl]-1-butanone | C21H23FINO2

1-(4-Fluorophenyl)-4-[4-hydroxy-4-(4-iodophenyl)-1-piperidinyl]-1-butanone

  • Molecular FormulaC21H23FINO2
  • Average mass467.316 Da
  • Monoisotopic mass467.075745 Da
  • ChemSpider ID25991719

More details:

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

1-(4-Fluorophenyl)-4-[4-hydroxy-4-(4-iodophenyl)-1-piperidinyl]-1-butanone [ACD/IUPAC Name]
1-(4-Fluorophényl)-4-[4-hydroxy-4-(4-iodophényl)-1-pipéridinyl]-1-butanone [French] [ACD/IUPAC Name]
1-(4-Fluorphenyl)-4-[4-hydroxy-4-(4-iodphenyl)-1-piperidinyl]-1-butanon [German] [ACD/IUPAC Name]
1-Butanone, 1-(4-fluorophenyl)-4-[4-hydroxy-4-(4-iodophenyl)-1-piperidinyl]- [ACD/Index Name]
1-(4-fluorophenyl)-4-{4-hydroxy-4-[4-(122i)iodophenyl]piperidin-1-yl}butan-1-one

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

Density: 1.5±0.1 g/cm3
Boiling Point: 560.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.6±3.0 kJ/mol
Flash Point: 292.5±30.1 °C
Index of Refraction: 1.613
Molar Refractivity: 109.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.45
ACD/LogD (pH 5.5): 1.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.93
ACD/LogD (pH 7.4): 2.72
ACD/BCF (pH 7.4): 42.85
ACD/KOC (pH 7.4): 294.09
Polar Surface Area: 41 Å2
Polarizability: 43.2±0.5 10-24cm3
Surface Tension: 50.3±3.0 dyne/cm
Molar Volume: 313.4±3.0 cm3

Click to predict properties on the Chemicalize site


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