3-Nitropropyl β-D-Glucopyranoside

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Properties Simple | Detailed

Formula C9H17NO8
IUPAC Name (2r,3s,4s,5r,6r)-2-(hydroxymethyl)-6-(3-nitropropoxy)tetrahydropyran-3,4,5-triol
Molecular Mass 267.233 g·mol−1
Heat of Formation -32.0 ± 16.7 kJ·mol−1
Dipole Moment 4.12 ± 1.08 D
Volume 245.12 Å 3
Surface Area 247.5 Å 2
Point Group Symmetry C1
Synonyms
  • (2r,3s,4s,5r,6r)-2-(hydroxymethyl)-6-(3-nitropropoxy)oxane-3,4,5-triol
  • (2r,3s,4s,5r,6r)-2-(hydroxymethyl)-6-(3-nitropropoxy)tetrahydropyran-3,4,5-triol
  • (2r,3s,4s,5r,6r)-2-methylol-6-(3-nitropropoxy)tetrahydropyran-3,4,5-triol
  • 3-nitro-1-propyl-beta-d-glucoside
  • 3-nitropropyl beta-d-glucopyranoside
  • 3-nitropropyl-beta-d-glucopyranoside
  • beta-d-glucopyranoside, 3-nitropropyl- (9ci)
  • c08507
  • glucopyranoside, 3-nitropropyl-, beta-d-
  • miserotoxin
CAS Number(s)
  • 24502-76-9
InChIKey JDJSHLXEHWCLEP-SYHAXYEDSA-N
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