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Structure

Octyl-beta-D-glucopyranoside

CAS
29836-26-8
Catalog Number
ACM29836268
Category
Other Products
Molecular Weight
292.37
Molecular Formula
C14H28O6

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Specification

Synonyms
1-O-Octyl-β-D-glucopyranoside
IUPAC Name
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-octoxyoxane-3,4,5-triol
Canonical SMILES
CCCCCCCCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
InChI
InChI=1S/C14H28O6/c1-2-3-4-5-6-7-8-19-14-13(18)12(17)11(16)10(9-15)20-14/h10-18H,2-9H2,1H3/t10-,11-,12+,13-,14-/m1/s1
InChI Key
HEGSGKPQLMEBJL-RKQHYHRCSA-N
Boiling Point
354.3 °C
Melting Point
105 °C
Density
1.08 g/ml
Appearance
White solid
EC Number
249-887-8
Exact Mass
292.18900
H-Bond Acceptor
6
H-Bond Donor
4
pKa
12.95±0.70
Refractive Index
-27 ° (C=1, MeOH)
Safety Description
24/25
Solubility In Water
Slightly

Upstream Synthesis Route 1

  • 2280-44-6
  • 111-87-5
  • 29836-26-8

Reference: [1]Tetrahedron,2004,vol. 60,p. 679 - 682
[2]Tetrahedron Asymmetry,2004,vol. 15,p. 1623 - 1629
[3]Tetrahedron Letters,1992,vol. 33,p. 4567 - 4570
[4]Canadian Journal of Chemistry,2002,vol. 80,p. 653 - 656
[5]Canadian Journal of Chemistry,2002,vol. 80,p. 653 - 656

Upstream Synthesis Route 2

  • 133-99-3
  • 111-87-5
  • 29836-26-8

Reference: [1]Agricultural and Biological Chemistry,1991,vol. 55,p. 1679 - 1681

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