ChemSpider 2D Image | 2-(4-Ethylphenoxy)-2-methyl-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone | C21H27N3O2

2-(4-Ethylphenoxy)-2-methyl-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone

  • Molecular FormulaC21H27N3O2
  • Average mass353.458 Da
  • Monoisotopic mass353.210327 Da
  • ChemSpider ID21632792

More details:






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

1-Propanone, 2-(4-ethylphenoxy)-2-methyl-1-[4-(2-pyridinyl)-1-piperazinyl]- [ACD/Index Name]
2-(4-Ethylphenoxy)-2-methyl-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanon [German] [ACD/IUPAC Name]
2-(4-Ethylphenoxy)-2-methyl-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone [ACD/IUPAC Name]
2-(4-Éthylphénoxy)-2-méthyl-1-[4-(2-pyridinyl)-1-pipérazinyl]-1-propanone [French] [ACD/IUPAC Name]
1-[2-(4-ethylphenoxy)-2-methylpropanoyl]-4-(2-pyridinyl)piperazine
2-(4-Ethyl-phenoxy)-2-methyl-1-(4-pyridin-2-yl-piperazin-1-yl)-propan-1-one
2-(4-ethylphenoxy)-2-methyl-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-1-one
MFCD09778215

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

Density: 1.1±0.1 g/cm3
Boiling Point: 546.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.6±3.0 kJ/mol
Flash Point: 284.6±30.1 °C
Index of Refraction: 1.571
Molar Refractivity: 102.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.05
ACD/LogD (pH 5.5): 1.08
ACD/BCF (pH 5.5): 1.06
ACD/KOC (pH 5.5): 7.67
ACD/LogD (pH 7.4): 2.37
ACD/BCF (pH 7.4): 20.52
ACD/KOC (pH 7.4): 148.84
Polar Surface Area: 46 Å2
Polarizability: 40.6±0.5 10-24cm3
Surface Tension: 47.3±3.0 dyne/cm
Molar Volume: 311.5±3.0 cm3

Click to predict properties on the Chemicalize site






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