ChemSpider 2D Image | 1-(4-Pentadecylphenoxy)-3-(1-piperazinyl)-2-propanol | C28H50N2O2

1-(4-Pentadecylphenoxy)-3-(1-piperazinyl)-2-propanol

  • Molecular FormulaC28H50N2O2
  • Average mass446.709 Da
  • Monoisotopic mass446.387238 Da
  • ChemSpider ID24795728

More details:






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

1-(4-Pentadecylphenoxy)-3-(1-piperazinyl)-2-propanol [ACD/IUPAC Name]
1-(4-Pentadecylphenoxy)-3-(1-piperazinyl)-2-propanol [German] [ACD/IUPAC Name]
1-(4-Pentadécylphénoxy)-3-(1-pipérazinyl)-2-propanol [French] [ACD/IUPAC Name]
1-Piperazineethanol, α-[(4-pentadecylphenoxy)methyl]- [ACD/Index Name]
1-(4-Pentadecyl-phenoxy)-3-piperazin-1-yl-propan-2-ol

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

Density: 1.0±0.1 g/cm3
Boiling Point: 578.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.1±3.0 kJ/mol
Flash Point: 303.7±30.1 °C
Index of Refraction: 1.505
Molar Refractivity: 136.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 1
ACD/LogP: 9.48
ACD/LogD (pH 5.5): 5.93
ACD/BCF (pH 5.5): 3573.59
ACD/KOC (pH 5.5): 1702.22
ACD/LogD (pH 7.4): 7.15
ACD/BCF (pH 7.4): 59565.96
ACD/KOC (pH 7.4): 28373.24
Polar Surface Area: 45 Å2
Polarizability: 54.2±0.5 10-24cm3
Surface Tension: 37.8±3.0 dyne/cm
Molar Volume: 461.3±3.0 cm3

Click to predict properties on the Chemicalize site






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