ChemSpider 2D Image | (2-{[(2S)-4-Carboxylato-1-methoxy-1-oxo-2-butanyl]amino}-2-oxoethyl)benzene | C14H16NO5

(2-{[(2S)-4-Carboxylato-1-methoxy-1-oxo-2-butanyl]amino}-2-oxoethyl)benzene

  • Molecular FormulaC14H16NO5
  • Average mass278.281 Da
  • Monoisotopic mass278.103394 Da
  • ChemSpider ID57540139

  • Charge - Charge

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2-{[(2S)-4-Carboxylato-1-methoxy-1-oxo-2-butanyl]amino}-2-oxoethyl)benzene [ACD/IUPAC Name]
(2-{[(2S)-4-Carboxylato-1-méthoxy-1-oxo-2-butanyl]amino}-2-oxoéthyl)benzène [French] [ACD/IUPAC Name]
(2-{[(2S)-4-Carboxylato-1-methoxy-1-oxo-2-butanyl]amino}-2-oxoethyl)benzol [German] [ACD/IUPAC Name]
L-Glutamic acid, N-(2-phenylacetyl)-, 1-methyl ester, ion(1-) [ACD/Index Name]
(2-{[(2S)-4-Carboxylato-1-methoxy-1-oxobutan-2-yl]amino}-2-oxoethyl)benzene
65414-94-0 [RN]

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

Density:
Boiling Point: 537.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.7±3.0 kJ/mol
Flash Point: 278.7±30.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 0.57
ACD/LogD (pH 5.5): 0.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.30
ACD/LogD (pH 7.4): -1.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 96 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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