Found 10 results

Search term: MF = 'C_{26}H_{30}ClF_{3}N_{2}O_{4}'
ChemSpider 2D Image | Ethyl 4-{4-[2-(4-chlorophenyl)-2-{[4-(trifluoromethyl)benzyl]oxy}ethyl]-1-piperazinyl}-4-oxobutanoate | C26H30ClF3N2O4

Ethyl 4-{4-[2-(4-chlorophenyl)-2-{[4-(trifluoromethyl)benzyl]oxy}ethyl]-1-piperazinyl}-4-oxobutanoate

  • Molecular FormulaC26H30ClF3N2O4
  • Average mass526.976 Da
  • Monoisotopic mass526.184631 Da
  • ChemSpider ID22748301

More details:

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

1-Piperazinebutanoic acid, 4-[2-(4-chlorophenyl)-2-[[4-(trifluoromethyl)phenyl]methoxy]ethyl]-γ-oxo-, ethyl ester [ACD/Index Name]
4-{4-[2-(4-Chlorophényl)-2-{[4-(trifluorométhyl)benzyl]oxy}éthyl]-1-pipérazinyl}-4-oxobutanoate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-{4-[2-(4-chlorophenyl)-2-{[4-(trifluoromethyl)benzyl]oxy}ethyl]-1-piperazinyl}-4-oxobutanoate [ACD/IUPAC Name]
Ethyl-4-{4-[2-(4-chlorphenyl)-2-{[4-(trifluormethyl)benzyl]oxy}ethyl]-1-piperazinyl}-4-oxobutanoat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 593.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.5±3.0 kJ/mol
Flash Point: 313.0±30.1 °C
Index of Refraction: 1.534
Molar Refractivity: 129.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 5.12
ACD/LogD (pH 5.5): 5.02
ACD/BCF (pH 5.5): 3319.30
ACD/KOC (pH 5.5): 9621.92
ACD/LogD (pH 7.4): 5.30
ACD/BCF (pH 7.4): 6210.06
ACD/KOC (pH 7.4): 18001.58
Polar Surface Area: 59 Å2
Polarizability: 51.4±0.5 10-24cm3
Surface Tension: 43.1±3.0 dyne/cm
Molar Volume: 417.4±3.0 cm3

Click to predict properties on the Chemicalize site


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