ChemSpider 2D Image | N-(3-Ethoxy-3-oxopropanoyl)-N-hexadecyl-2-methylalanine | C25H47NO5

N-(3-Ethoxy-3-oxopropanoyl)-N-hexadecyl-2-methylalanine

  • Molecular FormulaC25H47NO5
  • Average mass441.644 Da
  • Monoisotopic mass441.345428 Da
  • ChemSpider ID102728006

More details:

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

Alanine, N-(3-ethoxy-1,3-dioxopropyl)-N-hexadecyl-2-methyl- [ACD/Index Name]
N-(3-Ethoxy-3-oxopropanoyl)-N-hexadecyl-2-methylalanin [German] [ACD/IUPAC Name]
N-(3-Ethoxy-3-oxopropanoyl)-N-hexadecyl-2-methylalanine [ACD/IUPAC Name]
N-(3-Éthoxy-3-oxopropanoyl)-N-hexadécyl-2-méthylalanine [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 556.7±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 91.6±6.0 kJ/mol
Flash Point: 290.5±25.9 °C
Index of Refraction: 1.475
Molar Refractivity: 124.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 1
ACD/LogP: 8.62
ACD/LogD (pH 5.5): 5.94
ACD/BCF (pH 5.5): 5717.75
ACD/KOC (pH 5.5): 4045.49
ACD/LogD (pH 7.4): 4.54
ACD/BCF (pH 7.4): 229.97
ACD/KOC (pH 7.4): 162.71
Polar Surface Area: 84 Å2
Polarizability: 49.5±0.5 10-24cm3
Surface Tension: 37.6±3.0 dyne/cm
Molar Volume: 443.7±3.0 cm3

Click to predict properties on the Chemicalize site


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