N-[(3S,4R,5S,6R)-4,5-Dihydroxy-6-(Hydroxymethyl)-3-Piperidinyl]Acetamide

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Properties Simple | Detailed

Formula C8H16N2O4
IUPAC Name n-[(3s,4r,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-piperidyl]acetamide
Molecular Mass 204.224 g·mol−1
Heat of Formation -794.7 ± 16.7 kJ·mol−1
Dipole Moment 2.62 ± 1.08 D
Volume 241.62 Å 3
Surface Area 226.4 Å 2
HOMO Energy -9.52 ± 0.55 eV
LUMO Energy 1.04 ± eV
Point Group Symmetry C1
Synonyms
  • 2-acetamido-1,5-imino-1,2,5-trideoxy-d-galactitol
  • acetamide, n-(4,5-dihydroxy-6-(hydroxymethyl)-3-piperidinyl)-, (3s-(3alpha,4beta,5beta,6beta))-
  • acetamide, n-[4,5-dihydroxy-6-(hydroxymethyl)-3-piperidinyl]-, [3s-(3a,4b,5b,6b)]-
  • agal
  • n-[(3s,4r,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-piperidyl]acetamide
  • n-[(3s,4r,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)piperidin-3-yl]acetamide
  • n-[(3s,4r,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)piperidin-3-yl]ethanamide
  • n-[(3s,4r,5s,6r)-4,5-dihydroxy-6-methylol-3-piperidyl]acetamide
CAS Number(s)
  • 117894-14-1
InChIKey GBRAQQUMMCVTAV-OSMVPFSASA-N
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