ChemSpider 2D Image | alpha-[(3,5-Dioxo-1,2,4-oxadiazolidin-2-yl)methyl]-D-phenylalanine | C12H13N3O5

α-[(3,5-Dioxo-1,2,4-oxadiazolidin-2-yl)methyl]-D-phenylalanine

  • Molecular FormulaC12H13N3O5
  • Average mass279.249 Da
  • Monoisotopic mass279.085510 Da
  • ChemSpider ID23215787
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

D-Phenylalanine, α-[(3,5-dioxo-1,2,4-oxadiazolidin-2-yl)methyl]- [ACD/Index Name]
α-[(3,5-Dioxo-1,2,4-oxadiazolidin-2-yl)methyl]-D-phenylalanin [German] [ACD/IUPAC Name]
α-[(3,5-Dioxo-1,2,4-oxadiazolidin-2-yl)methyl]-D-phenylalanine [ACD/IUPAC Name]
α-[(3,5-Dioxo-1,2,4-oxadiazolidin-2-yl)méthyl]-D-phénylalanine [French] [ACD/IUPAC Name]
(S)-2-Amino-2-benzyl-3-(3,5-dioxo-[1,2,4]oxadiazolidin-2-yl)-propionic acid
Ä-Benzylquisqualic Acid
CHEMBL140862
α-BENZYLQUISQUALIC ACID

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.615
Molar Refractivity: 66.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.45
ACD/LogD (pH 5.5): -1.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.96
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 122 Å2
Polarizability: 26.2±0.5 10-24cm3
Surface Tension: 70.0±3.0 dyne/cm
Molar Volume: 189.5±3.0 cm3

Click to predict properties on the Chemicalize site






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