ChemSpider 2D Image | 2-[1-(2-Fluorobenzyl)-4-(3-phenyl-2-propyn-1-yl)-2-piperazinyl]ethanol | C22H25FN2O

2-[1-(2-Fluorobenzyl)-4-(3-phenyl-2-propyn-1-yl)-2-piperazinyl]ethanol

  • Molecular FormulaC22H25FN2O
  • Average mass352.445 Da
  • Monoisotopic mass352.195099 Da
  • ChemSpider ID22196310

More details:






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

2-[1-(2-Fluorbenzyl)-4-(3-phenyl-2-propin-1-yl)-2-piperazinyl]ethanol [German] [ACD/IUPAC Name]
2-[1-(2-Fluorobenzyl)-4-(3-phenyl-2-propyn-1-yl)-2-piperazinyl]ethanol [ACD/IUPAC Name]
2-[1-(2-Fluorobenzyl)-4-(3-phényl-2-propyn-1-yl)-2-pipérazinyl]éthanol [French] [ACD/IUPAC Name]
2-Piperazineethanol, 1-[(2-fluorophenyl)methyl]-4-(3-phenyl-2-propyn-1-yl)- [ACD/Index Name]
2-{1-[(2-FLUOROPHENYL)METHYL]-4-(3-PHENYLPROP-2-YN-1-YL)PIPERAZIN-2-YL}ETHAN-1-OL
2-{1-[(2-FLUOROPHENYL)METHYL]-4-(3-PHENYLPROP-2-YN-1-YL)PIPERAZIN-2-YL}ETHANOL

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 490.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.7±3.0 kJ/mol
Flash Point: 250.2±27.3 °C
Index of Refraction: 1.620
Molar Refractivity: 103.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.84
ACD/LogD (pH 5.5): 2.50
ACD/BCF (pH 5.5): 30.63
ACD/KOC (pH 5.5): 244.63
ACD/LogD (pH 7.4): 3.24
ACD/BCF (pH 7.4): 167.37
ACD/KOC (pH 7.4): 1336.78
Polar Surface Area: 27 Å2
Polarizability: 40.9±0.5 10-24cm3
Surface Tension: 55.5±5.0 dyne/cm
Molar Volume: 293.4±5.0 cm3

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