ChemSpider 2D Image | 2-Furyl(3-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-1-piperidinyl)methanone | C21H24F3N3O2

2-Furyl(3-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-1-piperidinyl)methanone

  • Molecular FormulaC21H24F3N3O2
  • Average mass407.429 Da
  • Monoisotopic mass407.182068 Da
  • ChemSpider ID22247231

More details:

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

2-Furyl(3-{4-[3-(trifluormethyl)phenyl]-1-piperazinyl}-1-piperidinyl)methanon [German] [ACD/IUPAC Name]
2-Furyl(3-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-1-piperidinyl)methanone [ACD/IUPAC Name]
2-Furyl(3-{4-[3-(trifluorométhyl)phényl]-1-pipérazinyl}-1-pipéridinyl)méthanone [French] [ACD/IUPAC Name]
Methanone, 2-furanyl[3-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]-1-piperidinyl]- [ACD/Index Name]
1-[1-(2-furoyl)-3-piperidinyl]-4-[3-(trifluoromethyl)phenyl]piperazine
1-[1-(FURAN-2-CARBONYL)PIPERIDIN-3-YL]-4-[3-(TRIFLUOROMETHYL)PHENYL]PIPERAZINE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 515.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.7±3.0 kJ/mol
Flash Point: 265.3±30.1 °C
Index of Refraction: 1.554
Molar Refractivity: 101.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.69
ACD/LogD (pH 5.5): 1.97
ACD/BCF (pH 5.5): 8.88
ACD/KOC (pH 5.5): 69.38
ACD/LogD (pH 7.4): 3.20
ACD/BCF (pH 7.4): 151.85
ACD/KOC (pH 7.4): 1186.36
Polar Surface Area: 40 Å2
Polarizability: 40.3±0.5 10-24cm3
Surface Tension: 44.3±3.0 dyne/cm
Molar Volume: 317.3±3.0 cm3

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