3-[(Iodoacetyl)Amino]-D-Alanine

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Properties Simple | Detailed

Formula C5H9IN2O3
IUPAC Name (2r)-2-amino-3-[(2-iodoacetyl)amino]propanoic acid
Molecular Mass 272.041 g·mol−1
Heat of Formation -513.0 ± 16.7 kJ·mol−1
Dipole Moment 1.84 ± 1.08 D
Volume 214.01 Å 3
Surface Area 212.84 Å 2
HOMO Energy -9.29 ± 0.55 eV
LUMO Energy 2.77 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-2-amino-3-(2-iodoethanoylamino)propanoic acid
  • (2r)-2-amino-3-[(2-iodo-1-oxoethyl)amino]propanoic acid
  • (2r)-2-amino-3-[(2-iodoacetyl)amino]propanoic acid
  • (2r)-2-amino-3-[(2-iodoacetyl)amino]propionic acid
  • 3-((iodoacetyl)amino)-l-alanine
  • iacpa
  • l-alanine, 3-((iodoacetyl)amino)-
  • n(3)-(iodoacetyl)-2,3-diaminopropanoic acid
  • n(3)-iodoacetyl-2,3-diaminopropanoic acid
CAS Number(s)
  • 129365-02-2
InChIKey MRJNQFAUDBTYTL-GSVOUGTGSA-N
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