Products 20581-45-7

CAS 20581-45-7 appears in our catalog under these names: Alpha-d-glucopyranosylphenylisothiocyanate, 95%, 4-Isothiocyanatophenyl-a-D-glucopyranoside. Offered by: Chemat Brand, Biosynth. Available pack sizes: on request, 25mg, 10mg.

Alpha-d-glucopyranosylphenylisothiocyanate, 95%
Chemat Brand
  • size: on request
  • Variants: 1
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4-Isothiocyanatophenyl-a-D-glucopyranoside
Biosynth
  • size: 25mg, 10mg
  • Variants: 2
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Structural formula: {0} (CAS {1})

(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(4-isothiocyanatophenoxy)oxane-3,4,5-triol (CAS 20581-45-7) is a chemical compound with the molecular formula C13H15NO6S and a molecular weight of 313.33 g/mol. IUPAC name: (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(4-isothiocyanatophenoxy)oxane-3,4,5-triol. InChIKey: RWANFUZQWINQBY-LBELIVKGSA-N.

Identity
Molecular formulaC13H15NO6S
Molecular weight313.33 g/mol
IUPAC name(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(4-isothiocyanatophenoxy)oxane-3,4,5-triol
InChIKeyRWANFUZQWINQBY-LBELIVKGSA-N
SMILESC1=CC(=CC=C1N=C=S)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O

Computed by PubChem (NCBI)

Synonyms: 4-Isothiocyanatophenyl-a-D-glucopyranoside, alpha-D-Glucopyranoside, 4-isothiocyanatophenyl, 4-Isothiocyanatophenyl ?-D-Glucopyranoside, a-D-Glucopyranosylphenyl Isothiocyanate, p-Isothiocyanatophenyl alpha-D-Glucopyranoside
Related forms of this compound
(2R,3S,4S,5S,6R)-2-(hydroxymethyl)-6-(4-isothiocyanatophenoxy)oxane-3,4,5-triol C13H15NO6S
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(4-isothiocyanatophenoxy)oxane-3,4,5-triol C13H15NO6S
Isomers (same molecular formula)
1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)pyrrolidine-2-carboxylic acid C13H15NO6S