ChemSpider 2D Image | 1-[4-({[3,5-Bis(trifluoromethyl)benzyl]oxy}methyl)-4-phenyl-1-piperidinyl]-2-pyrrolidinone | C25H26F6N2O2

1-[4-({[3,5-Bis(trifluoromethyl)benzyl]oxy}methyl)-4-phenyl-1-piperidinyl]-2-pyrrolidinone

  • Molecular FormulaC25H26F6N2O2
  • Average mass500.477 Da
  • Monoisotopic mass500.189850 Da
  • ChemSpider ID8250235

More details:

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

1-[4-({[3,5-Bis(trifluormethyl)benzyl]oxy}methyl)-4-phenyl-1-piperidinyl]-2-pyrrolidinon [German] [ACD/IUPAC Name]
1-[4-({[3,5-Bis(trifluoromethyl)benzyl]oxy}methyl)-4-phenyl-1-piperidinyl]-2-pyrrolidinone [ACD/IUPAC Name]
1-[4-({[3,5-Bis(trifluorométhyl)benzyl]oxy}méthyl)-4-phényl-1-pipéridinyl]-2-pyrrolidinone [French] [ACD/IUPAC Name]
2-Pyrrolidinone, 1-[4-[[[3,5-bis(trifluoromethyl)phenyl]methoxy]methyl]-4-phenyl-1-piperidinyl]- [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: 481.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.6±3.0 kJ/mol
Flash Point: 244.9±31.5 °C
Index of Refraction: 1.523
Molar Refractivity: 116.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.97
ACD/LogD (pH 5.5): 4.91
ACD/BCF (pH 5.5): 3141.59
ACD/KOC (pH 5.5): 11059.93
ACD/LogD (pH 7.4): 4.91
ACD/BCF (pH 7.4): 3169.41
ACD/KOC (pH 7.4): 11157.88
Polar Surface Area: 33 Å2
Polarizability: 46.3±0.5 10-24cm3
Surface Tension: 39.6±3.0 dyne/cm
Molar Volume: 381.7±3.0 cm3

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