ChemSpider 2D Image | Ethyl N-[(benzyloxy)carbonyl]-N-(2-methoxy-2-oxoethyl)-beta-alaninate | C16H21NO6

Ethyl N-[(benzyloxy)carbonyl]-N-(2-methoxy-2-oxoethyl)-β-alaninate

  • Molecular FormulaC16H21NO6
  • Average mass323.341 Da
  • Monoisotopic mass323.136902 Da
  • ChemSpider ID28467142

More details:

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

Ethyl N-[(benzyloxy)carbonyl]-N-(2-methoxy-2-oxoethyl)-β-alaninate [ACD/IUPAC Name]
Ethyl-N-[(benzyloxy)carbonyl]-N-(2-methoxy-2-oxoethyl)-β-alaninat [German] [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]-N-(2-méthoxy-2-oxoéthyl)-β-alaninate d'éthyle [French] [ACD/IUPAC Name]
β-Alanine, N-(2-methoxy-2-oxoethyl)-N-[(phenylmethoxy)carbonyl]-, ethyl ester [ACD/Index Name]
1-(2-methoxypyridin-3-yl)ethanol
1245646-09-6 [RN]
Ethyl 3-(((benzyloxy)carbonyl)(2-methoxy-2-oxoethyl)amino)propanoate
ethyl 3-((benzyloxycarbonyl)(2-methoxy-2-oxoethyl)amino)propanoate
ETHYL 3-{[(BENZYLOXY)CARBONYL](2-METHOXY-2-OXOETHYL)AMINO}PROPANOATE
ETHYL-3-(((BENZYLOXY)CARBONYL)(2-METHOXY-2-OXOETHYL)AMINO)PROPANOATE
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 432.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.9±3.0 kJ/mol
Flash Point: 215.5±28.7 °C
Index of Refraction: 1.514
Molar Refractivity: 81.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 3.49
ACD/LogD (pH 5.5): 2.78
ACD/BCF (pH 5.5): 76.79
ACD/KOC (pH 5.5): 778.22
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 76.79
ACD/KOC (pH 7.4): 778.22
Polar Surface Area: 82 Å2
Polarizability: 32.5±0.5 10-24cm3
Surface Tension: 44.4±3.0 dyne/cm
Molar Volume: 272.0±3.0 cm3

Click to predict properties on the Chemicalize site


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