ChemSpider 2D Image | 1-(4-{2-Hydroxy-3-[2-methyl-4-(2-methyl-2-propanyl)phenoxy]propyl}-1-piperazinyl)-2-(4-morpholinyl)ethanone | C24H39N3O4

1-(4-{2-Hydroxy-3-[2-methyl-4-(2-methyl-2-propanyl)phenoxy]propyl}-1-piperazinyl)-2-(4-morpholinyl)ethanone

  • Molecular FormulaC24H39N3O4
  • Average mass433.584 Da
  • Monoisotopic mass433.294067 Da
  • ChemSpider ID22398455

More details:

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

1-(4-{2-Hydroxy-3-[2-methyl-4-(2-methyl-2-propanyl)phenoxy]propyl}-1-piperazinyl)-2-(4-morpholinyl)ethanon [German] [ACD/IUPAC Name]
1-(4-{2-Hydroxy-3-[2-methyl-4-(2-methyl-2-propanyl)phenoxy]propyl}-1-piperazinyl)-2-(4-morpholinyl)ethanone [ACD/IUPAC Name]
1-(4-{2-Hydroxy-3-[2-méthyl-4-(2-méthyl-2-propanyl)phénoxy]propyl}-1-pipérazinyl)-2-(4-morpholinyl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[4-[3-[4-(1,1-dimethylethyl)-2-methylphenoxy]-2-hydroxypropyl]-1-piperazinyl]-2-(4-morpholinyl)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 610.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 95.3±3.0 kJ/mol
Flash Point: 323.1±31.5 °C
Index of Refraction: 1.538
Molar Refractivity: 121.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.46
ACD/LogD (pH 5.5): 2.20
ACD/BCF (pH 5.5): 19.88
ACD/KOC (pH 5.5): 201.51
ACD/LogD (pH 7.4): 2.77
ACD/BCF (pH 7.4): 74.49
ACD/KOC (pH 7.4): 755.13
Polar Surface Area: 65 Å2
Polarizability: 48.1±0.5 10-24cm3
Surface Tension: 44.0±3.0 dyne/cm
Molar Volume: 387.7±3.0 cm3

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