ChemSpider 2D Image | 2-{4-[(3-Chlorophenoxy)methyl]-1-[(5-propyl-1,2-oxazol-3-yl)carbonyl]-4-piperidinyl}-1-(1-piperidinyl)ethanone | C26H34ClN3O4

2-{4-[(3-Chlorophenoxy)methyl]-1-[(5-propyl-1,2-oxazol-3-yl)carbonyl]-4-piperidinyl}-1-(1-piperidinyl)ethanone

  • Molecular FormulaC26H34ClN3O4
  • Average mass488.019 Da
  • Monoisotopic mass487.223785 Da
  • ChemSpider ID68630476

More details:

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

2-{4-[(3-Chlorophenoxy)methyl]-1-[(5-propyl-1,2-oxazol-3-yl)carbonyl]-4-piperidinyl}-1-(1-piperidinyl)ethanone [ACD/IUPAC Name]
2-{4-[(3-Chlorophénoxy)méthyl]-1-[(5-propyl-1,2-oxazol-3-yl)carbonyl]-4-pipéridinyl}-1-(1-pipéridinyl)éthanone [French] [ACD/IUPAC Name]
2-{4-[(3-Chlorphenoxy)methyl]-1-[(5-propyl-1,2-oxazol-3-yl)carbonyl]-4-piperidinyl}-1-(1-piperidinyl)ethanon [German] [ACD/IUPAC Name]
Ethanone, 2-[4-[(3-chlorophenoxy)methyl]-1-[(5-propyl-3-isoxazolyl)carbonyl]-4-piperidinyl]-1-(1-piperidinyl)- [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: 679.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.8±3.0 kJ/mol
Flash Point: 365.0±28.7 °C
Index of Refraction: 1.558
Molar Refractivity: 130.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.72
ACD/LogD (pH 5.5): 4.04
ACD/BCF (pH 5.5): 695.48
ACD/KOC (pH 5.5): 3767.97
ACD/LogD (pH 7.4): 4.04
ACD/BCF (pH 7.4): 695.48
ACD/KOC (pH 7.4): 3767.98
Polar Surface Area: 76 Å2
Polarizability: 51.7±0.5 10-24cm3
Surface Tension: 48.1±3.0 dyne/cm
Molar Volume: 404.5±3.0 cm3

Click to predict properties on the Chemicalize site


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