(2S,3S,4R)-2-[(1S)-1,2-Dihydroxyethyl]-3,4-Pyrrolidinediol

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Properties Simple | Detailed

Formula C6H13NO4
IUPAC Name (2s,3s,4r)-2-[(1s)-1,2-dihydroxyethyl]pyrrolidine-3,4-diol
Molecular Mass 163.172 g·mol−1
Heat of Formation -775.6 ± 16.7 kJ·mol−1
Dipole Moment 2.82 ± 1.08 D
Volume 191.88 Å 3
Surface Area 183.18 Å 2
HOMO Energy -9.74 ± 0.55 eV
LUMO Energy 4.78 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3s,4r)-2-[(1s)-1,2-dihydroxyethyl]pyrrolidine-3,4-diol
  • 1,4-dideoxy-1,4-imino-d-tallitol
  • 117770-06-6 (hydrochloride)
  • 3,4-pyrrolidinediol, 2-(1,2-dihydroxyethyl)-, (2s-(2a(r*),3b,4b))-
  • 3,4-pyrrolidinediol, 2-(1,2-dihydroxyethyl)-, [2s-[2a(r*),3b,4b]]-
CAS Number(s)
  • 115509-95-0
InChIKey RVNSAAIWCWTCTJ-ARQDHWQXSA-N
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