4-Fluorophenyl-beta-D-glucopyranoside structure

4-Fluorophenyl-beta-D-glucopyranoside

(2S,3R,4S,5S,6R)-2-(4-fluorophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol

Also Known As: 4-Fluorophenyl beta-glucoside|4-Fluorophenyl-beta-D-glucopyranoside|.beta.-D-glucopyranoside, 4-fluorophenyl|819F528|(2S,3R,4S,5S,6R)-2-(4-fluorophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol|(2S,3R,4S,5S,6R)-2-(4-Fluorophenoxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol|(2S,3R,4S,5S,6R)-2-(4-fluorophenoxy)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol

CAS: 50819-52-8
Molecular Formula C12H15FO6
Molecular Weight 274.08527 g/mol
LogP -0.3
Topological Polar Surface Area 99.4 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 7
Rotatable Bonds 3
Exact Mass 274.08527
Monoisotopic Mass 274.08527
Heavy Atoms 19
Complexity 283.0

Chemical Identifiers

CAS Number 50819-52-8
SMILES C1=CC(=CC=C1O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)F
InChIKey BWCHYPPTNWPJDG-RMPHRYRLSA-N

Product Overview

4-Fluorophenyl-beta-D-glucopyranoside (CAS 50819-52-8), with molecular formula C12H15FO6 and molecular weight 274.08527 g/mol. IUPAC: (2S,3R,4S,5S,6R)-2-(4-fluorophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol.

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