ChemSpider 2D Image | Ethyl 1-{1-[(4-chlorophenoxy)acetyl]-4-piperidinyl}-5-(4-fluorophenyl)-1H-pyrazole-3-carboxylate | C25H25ClFN3O4

Ethyl 1-{1-[(4-chlorophenoxy)acetyl]-4-piperidinyl}-5-(4-fluorophenyl)-1H-pyrazole-3-carboxylate

  • Molecular FormulaC25H25ClFN3O4
  • Average mass485.935 Da
  • Monoisotopic mass485.151764 Da
  • ChemSpider ID22771197

More details:






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

1-{1-[2-(4-Chlorophénoxy)acétyl]-4-pipéridinyl}-5-(4-fluorophényl)-1H-pyrazole-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
1H-Pyrazole-3-carboxylic acid, 1-[1-[2-(4-chlorophenoxy)acetyl]-4-piperidinyl]-5-(4-fluorophenyl)-, ethyl ester [ACD/Index Name]
Ethyl 1-{1-[(4-chlorophenoxy)acetyl]-4-piperidinyl}-5-(4-fluorophenyl)-1H-pyrazole-3-carboxylate [ACD/IUPAC Name]
Ethyl-1-{1-[(4-chlorphenoxy)acetyl]-4-piperidinyl}-5-(4-fluorphenyl)-1H-pyrazol-3-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 674.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.0±3.0 kJ/mol
Flash Point: 361.4±31.5 °C
Index of Refraction: 1.613
Molar Refractivity: 127.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.35
ACD/LogD (pH 5.5): 4.95
ACD/BCF (pH 5.5): 3373.54
ACD/KOC (pH 5.5): 11668.06
ACD/LogD (pH 7.4): 4.95
ACD/BCF (pH 7.4): 3373.55
ACD/KOC (pH 7.4): 11668.07
Polar Surface Area: 74 Å2
Polarizability: 50.5±0.5 10-24cm3
Surface Tension: 47.4±7.0 dyne/cm
Molar Volume: 365.7±7.0 cm3

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