ChemSpider 2D Image | ethyl 4-oxo-4-[2-(piperidinomethyl)phenyl]butyrate | C18H25NO3

ethyl 4-oxo-4-[2-(piperidinomethyl)phenyl]butyrate

  • Molecular FormulaC18H25NO3
  • Average mass303.396 Da
  • Monoisotopic mass303.183441 Da
  • ChemSpider ID21399946

More details:

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

4-Oxo-4-[2-(1-pipéridinylméthyl)phényl]butanoate d'éthyle [French] [ACD/IUPAC Name]
898773-91-6 [RN]
Benzenebutanoic acid, γ-oxo-2-(1-piperidinylmethyl)-, ethyl ester [ACD/Index Name]
Ethyl 4-oxo-4-[2-(1-piperidinylmethyl)phenyl]butanoate [ACD/IUPAC Name]
ethyl 4-oxo-4-[2-(piperidinomethyl)phenyl]butyrate
Ethyl γ-oxo-2-(1-piperidinylmethyl)benzenebutanoate
Ethyl-4-oxo-4-[2-(1-piperidinylmethyl)phenyl]butanoat [German] [ACD/IUPAC Name]
ethyl 4-oxo-4-[2-(piperidin-1-ylmethyl)phenyl]butanoate
ETHYL 4-OXO-4-[2-(PIPERIDIN-1-YLMETHYL)PHENYL]BUTYRATE
Ethyl 4-oxo-4-{2-[(piperidin-1-yl)methyl]phenyl}butanoate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 435.7±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.2±3.0 kJ/mol
Flash Point: 217.3±25.9 °C
Index of Refraction: 1.534
Molar Refractivity: 86.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.92
ACD/LogD (pH 5.5): 0.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.29
ACD/LogD (pH 7.4): 2.06
ACD/BCF (pH 7.4): 10.83
ACD/KOC (pH 7.4): 85.07
Polar Surface Area: 47 Å2
Polarizability: 34.1±0.5 10-24cm3
Surface Tension: 43.3±3.0 dyne/cm
Molar Volume: 276.9±3.0 cm3

Click to predict properties on the Chemicalize site


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