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

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Properties Simple | Detailed

Formula C5H9IN2O3
IUPAC Name (2s)-2-amino-3-[(2-iodoacetyl)amino]propanoic acid
Molecular Mass 272.041 g·mol−1
Heat of Formation -517.4 ± 16.7 kJ·mol−1
Dipole Moment 3.07 ± 1.08 D
Volume 215.35 Å 3
Surface Area 203.4 Å 2
HOMO Energy -9.28 ± 0.55 eV
LUMO Energy -0.18 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-3-(2-iodoethanoylamino)propanoic acid
  • (2s)-2-amino-3-[(2-iodo-1-oxoethyl)amino]propanoic acid
  • (2s)-2-amino-3-[(2-iodoacetyl)amino]propanoic acid
  • (2s)-2-amino-3-[(2-iodoacetyl)amino]propionic acid
InChIKey MRJNQFAUDBTYTL-VKHMYHEASA-N
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