N-{(2R)-2-Carboxy-2-[(Carboxymethyl)Amino]Ethyl}-L-Aspartic Acid

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Formula C9H14N2O8
IUPAC Name (2s)-2-[[(2r)-2-carboxy-2-(carboxymethylamino)ethyl]amino]butanedioic acid
Molecular Mass 278.216 g·mol−1
Heat of Formation -1490.1 ± 16.7 kJ·mol−1
Dipole Moment 2.71 ± 1.08 D
Volume 309.19 Å 3
Surface Area 285.14 Å 2
HOMO Energy -9.82 ± 0.55 eV
LUMO Energy 0.23 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[[(2r)-2-(carboxymethylamino)-3-hydroxy-3-keto-propyl]amino]succinic acid
  • (2s)-2-[[(2r)-2-(carboxymethylamino)-3-hydroxy-3-oxo-propyl]amino]butanedioic acid
  • (2s)-2-[[(2r)-2-(carboxymethylamino)-3-hydroxy-3-oxopropyl]amino]butanedioic acid
  • aspartic acid, n-(2-carboxy-2-((carboxymethyl)amino)ethyl)-
  • aspergillomarasmine b
CAS Number(s)
  • 3262-58-6
InChIKey FZCSTZYAHCUGEM-CRCLSJGQSA-N
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