ChemSpider 2D Image | 1'-(3,4-Difluorophenyl)-3-(3-isopropyl-1,2,4-oxadiazol-5-yl)-1,4'-bipiperidine | C21H28F2N4O

1'-(3,4-Difluorophenyl)-3-(3-isopropyl-1,2,4-oxadiazol-5-yl)-1,4'-bipiperidine

  • Molecular FormulaC21H28F2N4O
  • Average mass390.470 Da
  • Monoisotopic mass390.223114 Da
  • ChemSpider ID67900958

More details:

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

1'-(3,4-Difluorophenyl)-3-(3-isopropyl-1,2,4-oxadiazol-5-yl)-1,4'-bipiperidine [ACD/IUPAC Name]
1'-(3,4-Difluorophényl)-3-(3-isopropyl-1,2,4-oxadiazol-5-yl)-1,4'-bipipéridine [French] [ACD/IUPAC Name]
1'-(3,4-Difluorphenyl)-3-(3-isopropyl-1,2,4-oxadiazol-5-yl)-1,4'-bipiperidin [German] [ACD/IUPAC Name]
1,4'-Bipiperidine, 1'-(3,4-difluorophenyl)-3-[3-(1-methylethyl)-1,2,4-oxadiazol-5-yl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 524.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.8±3.0 kJ/mol
Flash Point: 271.0±32.9 °C
Index of Refraction: 1.546
Molar Refractivity: 102.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.67
ACD/LogD (pH 5.5): 1.42
ACD/BCF (pH 5.5): 2.05
ACD/KOC (pH 5.5): 13.46
ACD/LogD (pH 7.4): 3.11
ACD/BCF (pH 7.4): 100.87
ACD/KOC (pH 7.4): 663.89
Polar Surface Area: 45 Å2
Polarizability: 40.8±0.5 10-24cm3
Surface Tension: 45.9±3.0 dyne/cm
Molar Volume: 324.8±3.0 cm3

Click to predict properties on the Chemicalize site


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