ChemSpider 2D Image | Ethyl 5-{3-[(4-methyl-1-piperazinyl)methyl]phenyl}-5-oxopentanoate | C19H28N2O3

Ethyl 5-{3-[(4-methyl-1-piperazinyl)methyl]phenyl}-5-oxopentanoate

  • Molecular FormulaC19H28N2O3
  • Average mass332.437 Da
  • Monoisotopic mass332.209991 Da
  • ChemSpider ID21399780

More details:

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

5-{3-[(4-Méthyl-1-pipérazinyl)méthyl]phényl}-5-oxopentanoate d'éthyle [French] [ACD/IUPAC Name]
898789-49-6 [RN]
Benzenepentanoic acid, 3-[(4-methyl-1-piperazinyl)methyl]-δ-oxo-, ethyl ester [ACD/Index Name]
Ethyl 5-{3-[(4-methyl-1-piperazinyl)methyl]phenyl}-5-oxopentanoate [ACD/IUPAC Name]
Ethyl-5-{3-[(4-methyl-1-piperazinyl)methyl]phenyl}-5-oxopentanoat [German] [ACD/IUPAC Name]
ETHYL 5-[3-(4-METHYLPIPERAZIN-1-YLMETHYL)PHENYL]-5-OXOVALERATE
Ethyl 5-[3-(4-methylpiperazinomethyl)phenyl]-5-oxovalerate
Ethyl 5-[3-(4-methylpiperazinomethyl)-phenyl]-5-oxovalerate
ethyl 5-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-5-oxopentanoate
Ethyl 5-{3-[(4-methylpiperazin-1-yl)methyl]phenyl}-5-oxopentanoate
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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: 460.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.1±3.0 kJ/mol
Flash Point: 232.1±28.7 °C
Index of Refraction: 1.533
Molar Refractivity: 94.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.34
ACD/LogD (pH 5.5): 0.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.84
ACD/LogD (pH 7.4): 1.70
ACD/BCF (pH 7.4): 9.07
ACD/KOC (pH 7.4): 128.24
Polar Surface Area: 50 Å2
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 42.4±3.0 dyne/cm
Molar Volume: 304.4±3.0 cm3

Click to predict properties on the Chemicalize site


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