1,4-Dideoxy-1,4-Imino-Arabinitol

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Properties Simple | Detailed

Formula C5H11NO3
IUPAC Name (2r,3r,4r)-2-(hydroxymethyl)pyrrolidine-3,4-diol
Molecular Mass 133.146 g·mol−1
Heat of Formation -567.4 ± 16.7 kJ·mol−1
Dipole Moment 0.93 ± 1.08 D
Volume 159.92 Å 3
Surface Area 161.08 Å 2
HOMO Energy -9.54 ± 0.55 eV
LUMO Energy 4.96 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4r)-2-(hydroxymethyl)pyrrolidine-3,4-diol
  • (2r,3r,4r)-2-methylolpyrrolidine-3,4-diol
  • 1,4-dideoxy-1,4-imino-d-arabinitol
  • 100991-92-2 (hcl)
  • 1ab
  • 2-hydroxymethyl-3,4-pyrrolidinediol
  • 3,4-pyrrolidinediol, 2-(hydroxymethyl-14c)-, (2r,3r,4r)-
CAS Number(s)
  • 259140-24-4
InChIKey OQEBIHBLFRADNM-UOWFLXDJSA-N
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