ChemSpider 2D Image | 1-(4-Benzyl-1-piperidinyl)-4-(4-fluorophenyl)-1-butanone | C22H26FNO

1-(4-Benzyl-1-piperidinyl)-4-(4-fluorophenyl)-1-butanone

  • Molecular FormulaC22H26FNO
  • Average mass339.446 Da
  • Monoisotopic mass339.199829 Da
  • ChemSpider ID28868590

More details:

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

1-(4-Benzyl-1-piperidinyl)-4-(4-fluorophenyl)-1-butanone [ACD/IUPAC Name]
1-(4-Benzyl-1-pipéridinyl)-4-(4-fluorophényl)-1-butanone [French] [ACD/IUPAC Name]
1-(4-Benzyl-1-piperidinyl)-4-(4-fluorphenyl)-1-butanon [German] [ACD/IUPAC Name]
1-Butanone, 4-(4-fluorophenyl)-1-[4-(phenylmethyl)-1-piperidinyl]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 498.1±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.6±3.0 kJ/mol
Flash Point: 255.0±24.0 °C
Index of Refraction: 1.561
Molar Refractivity: 98.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.40
ACD/LogD (pH 5.5): 5.03
ACD/BCF (pH 5.5): 3891.80
ACD/KOC (pH 5.5): 12924.79
ACD/LogD (pH 7.4): 5.03
ACD/BCF (pH 7.4): 3891.81
ACD/KOC (pH 7.4): 12924.80
Polar Surface Area: 20 Å2
Polarizability: 39.1±0.5 10-24cm3
Surface Tension: 44.0±3.0 dyne/cm
Molar Volume: 305.0±3.0 cm3

Click to predict properties on the Chemicalize site


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