N~2~-Acetyl-N~6~-[(1E)-3-Oxo-1-Propen-1-Yl]-L-Lysine

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Formula C11H18N2O4
IUPAC Name (2s)-2-acetamido-6-[[(e)-3-oxoprop-1-enyl]amino]hexanoic acid
Molecular Mass 242.272 g·mol−1
Heat of Formation -735.4 ± 16.7 kJ·mol−1
Dipole Moment 9.27 ± 1.08 D
Volume 305.51 Å 3
Surface Area 295.77 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy 0.19 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-acetamido-6-[[(e)-3-ketoprop-1-enyl]amino]hexanoic acid
  • (2s)-2-acetamido-6-[[(e)-3-oxoprop-1-enyl]amino]hexanoic acid
  • n(alpha)-acetyl-epsilon-(2-propenal)lysine
CAS Number(s)
  • 99124-74-0
InChIKey CFVRQIPDMDQVDT-QBBOHKLWSA-N
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