ChemSpider 2D Image | (2S)-2-[(2-Hydroxyethyl)amino]-4-oxo-4-propoxybutanoate | C9H16NO5

(2S)-2-[(2-Hydroxyethyl)amino]-4-oxo-4-propoxybutanoate

  • Molecular FormulaC9H16NO5
  • Average mass218.228 Da
  • Monoisotopic mass218.103394 Da
  • ChemSpider ID57540450

  • Charge - Charge

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-[(2-Hydroxyethyl)amino]-4-oxo-4-propoxybutanoat [German] [ACD/IUPAC Name]
(2S)-2-[(2-Hydroxyethyl)amino]-4-oxo-4-propoxybutanoate [ACD/IUPAC Name]
(2S)-2-[(2-Hydroxyéthyl)amino]-4-oxo-4-propoxybutanoate [French] [ACD/IUPAC Name]
L-Aspartic acid, N-(2-hydroxyethyl)-, 4-propyl ester, ion(1-) [ACD/Index Name]
64616-64-4 [RN]

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

Density:
Boiling Point: 407.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 76.3±6.0 kJ/mol
Flash Point: 200.5±28.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 0.77
ACD/LogD (pH 5.5): -1.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 99 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement