ChemSpider 2D Image | Ethyl 4-{3-[(4-methyl-1-piperazinyl)methyl]benzoyl}benzoate | C22H26N2O3

Ethyl 4-{3-[(4-methyl-1-piperazinyl)methyl]benzoyl}benzoate

  • Molecular FormulaC22H26N2O3
  • Average mass366.453 Da
  • Monoisotopic mass366.194336 Da
  • ChemSpider ID21399739

More details:

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

4-{3-[(4-Méthyl-1-pipérazinyl)méthyl]benzoyl}benzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[3-[(4-methyl-1-piperazinyl)methyl]benzoyl]-, ethyl ester [ACD/Index Name]
Ethyl 4-{3-[(4-methyl-1-piperazinyl)methyl]benzoyl}benzoate [ACD/IUPAC Name]
Ethyl-4-{3-[(4-methyl-1-piperazinyl)methyl]benzoyl}benzoat [German] [ACD/IUPAC Name]
4'-CARBOETHOXY-3-(4-METHYLPIPERAZIN-1-YLMETHYL)BENZOPHENONE
4'-carboethoxy-3-(4-methylpiperazinomethyl) benzophenone
4-carboethoxy-3-(4-methylpiperazinomethyl) benzophenone
4'-carboethoxy-3-(4-methylpiperazinomethyl)benzophenone
898788-52-8 [RN]
ethyl 4-[3-[(4-methylpiperazin-1-yl)methyl]benzoyl]benzoate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 509.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.9±3.0 kJ/mol
Flash Point: 261.6±30.1 °C
Index of Refraction: 1.576
Molar Refractivity: 105.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.82
ACD/LogD (pH 5.5): 1.02
ACD/BCF (pH 5.5): 1.13
ACD/KOC (pH 5.5): 9.87
ACD/LogD (pH 7.4): 2.67
ACD/BCF (pH 7.4): 50.56
ACD/KOC (pH 7.4): 441.35
Polar Surface Area: 50 Å2
Polarizability: 41.9±0.5 10-24cm3
Surface Tension: 45.3±3.0 dyne/cm
Molar Volume: 319.4±3.0 cm3

Click to predict properties on the Chemicalize site


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