ChemSpider 2D Image | Ethyl N-(3-cyclohexylpropanoyl)-N-[2-(2-hydroxyethoxy)ethyl]-beta-alaninate | C18H33NO5

Ethyl N-(3-cyclohexylpropanoyl)-N-[2-(2-hydroxyethoxy)ethyl]-β-alaninate

  • Molecular FormulaC18H33NO5
  • Average mass343.458 Da
  • Monoisotopic mass343.235870 Da
  • ChemSpider ID27397309

More details:

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

Ethyl N-(3-cyclohexylpropanoyl)-N-[2-(2-hydroxyethoxy)ethyl]-β-alaninate [ACD/IUPAC Name]
Ethyl-N-(3-cyclohexylpropanoyl)-N-[2-(2-hydroxyethoxy)ethyl]-β-alaninat [German] [ACD/IUPAC Name]
N-(3-Cyclohexylpropanoyl)-N-[2-(2-hydroxyéthoxy)éthyl]-β-alaninate d'éthyle [French] [ACD/IUPAC Name]
β-Alanine, N-(3-cyclohexyl-1-oxopropyl)-N-[2-(2-hydroxyethoxy)ethyl]-, ethyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 489.0±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 87.0±6.0 kJ/mol
Flash Point: 249.6±25.9 °C
Index of Refraction: 1.486
Molar Refractivity: 92.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 0
ACD/LogP: 2.76
ACD/LogD (pH 5.5): 2.76
ACD/BCF (pH 5.5): 74.08
ACD/KOC (pH 5.5): 758.52
ACD/LogD (pH 7.4): 2.76
ACD/BCF (pH 7.4): 74.08
ACD/KOC (pH 7.4): 758.52
Polar Surface Area: 76 Å2
Polarizability: 36.5±0.5 10-24cm3
Surface Tension: 41.5±3.0 dyne/cm
Molar Volume: 320.8±3.0 cm3

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