ChemSpider 2D Image | Ethyl 4-acetyl-2-[({[N-(2,2-dimethylpropanoyl)alanyl]oxy}acetyl)amino]-5-methyl-3-furoate | C20H28N2O8

Ethyl 4-acetyl-2-[({[N-(2,2-dimethylpropanoyl)alanyl]oxy}acetyl)amino]-5-methyl-3-furoate

  • Molecular FormulaC20H28N2O8
  • Average mass424.445 Da
  • Monoisotopic mass424.184570 Da
  • ChemSpider ID30444126

More details:

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

3-Furancarboxylic acid, 4-acetyl-2-[[2-[2-[(2,2-dimethyl-1-oxopropyl)amino]-1-oxopropoxy]acetyl]amino]-5-methyl-, ethyl ester [ACD/Index Name]
4-Acétyl-2-[(2-{[N-(2,2-diméthylpropanoyl)alanyl]oxy}acétyl)amino]-5-méthyl-3-furoate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-acetyl-2-[({[N-(2,2-dimethylpropanoyl)alanyl]oxy}acetyl)amino]-5-methyl-3-furoate [ACD/IUPAC Name]
Ethyl-4-acetyl-2-[({[N-(2,2-dimethylpropanoyl)alanyl]oxy}acetyl)amino]-5-methyl-3-furoat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 642.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.8±3.0 kJ/mol
Flash Point: 342.3±31.5 °C
Index of Refraction: 1.521
Molar Refractivity: 106.5±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 2.58
ACD/LogD (pH 5.5): 2.29
ACD/BCF (pH 5.5): 32.49
ACD/KOC (pH 5.5): 420.47
ACD/LogD (pH 7.4): 2.29
ACD/BCF (pH 7.4): 32.49
ACD/KOC (pH 7.4): 420.39
Polar Surface Area: 141 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 44.2±3.0 dyne/cm
Molar Volume: 349.4±3.0 cm3

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