ChemSpider 2D Image | Methyl N-(2,2-dimethoxyethyl)-beta-alaninate | C8H17NO4

Methyl N-(2,2-dimethoxyethyl)-β-alaninate

  • Molecular FormulaC8H17NO4
  • Average mass191.225 Da
  • Monoisotopic mass191.115753 Da
  • ChemSpider ID31037009

More details:

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

Methyl N-(2,2-dimethoxyethyl)-β-alaninate [ACD/IUPAC Name]
Methyl-N-(2,2-dimethoxyethyl)-β-alaninat [German] [ACD/IUPAC Name]
N-(2,2-Diméthoxyéthyl)-β-alaninate de méthyle [French] [ACD/IUPAC Name]
β-Alanine, N-(2,2-dimethoxyethyl)-, methyl ester [ACD/Index Name]
86017-91-6 [RN]
methyl 3-[(2,2-dimethoxyethyl)amino]propanoate
MFCD16620550

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

Density: 1.0±0.1 g/cm3
Boiling Point: 242.3±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.9±3.0 kJ/mol
Flash Point: 100.3±24.6 °C
Index of Refraction: 1.429
Molar Refractivity: 47.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 0.47
ACD/LogD (pH 5.5): -0.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.41
ACD/LogD (pH 7.4): 0.37
ACD/BCF (pH 7.4): 1.09
ACD/KOC (pH 7.4): 35.73
Polar Surface Area: 57 Å2
Polarizability: 19.0±0.5 10-24cm3
Surface Tension: 31.3±3.0 dyne/cm
Molar Volume: 186.0±3.0 cm3

Click to predict properties on the Chemicalize site


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