5-Amino-2,4,5-Trideoxy-2-(2-Oxo-1-Azetidinyl)-D-Threo-Pentonic Acid

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Properties Simple | Detailed

Formula C8H14N2O4
IUPAC Name (2s,3r)-5-amino-3-hydroxy-2-(2-oxoazetidin-1-yl)pentanoic acid
Molecular Mass 202.208 g·mol−1
Heat of Formation -672.0 ± 16.7 kJ·mol−1
Dipole Moment 6.55 ± 1.08 D
Volume 239.3 Å 3
Surface Area 215.55 Å 2
HOMO Energy -9.60 ± 0.55 eV
LUMO Energy 0.53 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3r)-5-amino-3-hydroxy-2-(2-ketoazetidin-1-yl)valeric acid
  • (2s,3r)-5-amino-3-hydroxy-2-(2-oxo-1-azetidinyl)pentanoic acid
  • (2s,3r)-5-amino-3-hydroxy-2-(2-oxoazetidin-1-yl)pentanoic acid
  • 5-amino-2,4,5-trideoxy-2-(2-oxoazetidin-1-yl)-d-threo-pentonic acid
  • 5-amino-3-hydroxy-2-(2-oxo-azetidin-1-yl)-pentanoic acid
  • d-threo-pentonic acid, 5-amino-2,4,5-trideoxy-2-(2-oxo-1-azetidinyl)-
  • pcv
  • proclavaminate
  • proclavaminic acid
CAS Number(s)
  • 112240-59-2
InChIKey NMCINKPVAOXDJH-VDTYLAMSSA-N
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