ChemSpider 2D Image | Ethyl N-[(2,2-diethoxyethyl)carbamoyl]-beta-alaninate | C12H24N2O5

Ethyl N-[(2,2-diethoxyethyl)carbamoyl]-β-alaninate

  • Molecular FormulaC12H24N2O5
  • Average mass276.329 Da
  • Monoisotopic mass276.168518 Da
  • ChemSpider ID22472538

More details:

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

Ethyl N-[(2,2-diethoxyethyl)carbamoyl]-β-alaninate [ACD/IUPAC Name]
Ethyl-N-[(2,2-diethoxyethyl)carbamoyl]-β-alaninat [German] [ACD/IUPAC Name]
N-[(2,2-Diéthoxyéthyl)carbamoyl]-β-alaninate d'éthyle [French] [ACD/IUPAC Name]
β-Alanine, N-[[(2,2-diethoxyethyl)amino]carbonyl]-, 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: 428.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.4±3.0 kJ/mol
Flash Point: 212.9±28.7 °C
Index of Refraction: 1.456
Molar Refractivity: 70.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 1.34
ACD/LogD (pH 5.5): 0.98
ACD/BCF (pH 5.5): 3.27
ACD/KOC (pH 5.5): 81.18
ACD/LogD (pH 7.4): 0.98
ACD/BCF (pH 7.4): 3.27
ACD/KOC (pH 7.4): 81.18
Polar Surface Area: 86 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 36.0±3.0 dyne/cm
Molar Volume: 258.0±3.0 cm3

Click to predict properties on the Chemicalize site


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