CAS 14049-03-7 | D-Glucose, 3-deoxy-3-fluoro- | CAS Number 14049-03-7

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14049-03-7 | D-Glucose, 3-deoxy-3-fluoro-

CAS No: 14049-03-7 Catalog No: AG001CJ9 MDL No:MFCD00063302

Product Description

Catalog Number:

AG001CJ9

Chemical Name:

D-Glucose, 3-deoxy-3-fluoro-

CAS Number:

14049-03-7

Molecular Formula:

C6H11FO5

Molecular Weight:

182.1469

MDL Number:

MFCD00063302

IUPAC Name:

(2S,3S,4R,5R)-3-fluoro-2,4,5,6-tetrahydroxyhexanal

InChI:

InChI=1S/C6H11FO5/c7-5(3(10)1-8)6(12)4(11)2-9/h1,3-6,9-12H,2H2/t3-,4+,5+,6+/m0/s1

InChI Key:

RMHCJIQOFXULDL-SLPGGIOYSA-N

SMILES:

OC[C@H]([C@H]([C@@H]([C@H](C=O)O)F)O)O

UNII:

8316U79EZ5

Properties

Complexity:

142

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

182.059g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

182.147g/mol

Monoisotopic Mass:

182.059g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

98A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-2.4

Literature

Title	Journal
An expedient enzymatic route to isomeric 2-, 3- and 6-monodeoxy-monofluoro-maltose derivatives.	Carbohydrate research 20120901
Co-crystals of 3-deoxy-3-fluoro-α-D-glucopyranose and 3-deoxy-3-fluoro-β-D-glucopyranose.	Acta crystallographica. Section C, Crystal structure communications 20101115
4,6-O-benzylidene-directed beta-mannopyranosylation and alpha-glucopyranosylation: the 2-deoxy-2-fluoro and 3-deoxy-3-fluoro series of donors and the importance of the O2-C2-C3-O3 interaction.	The Journal of organic chemistry 20070302
Determination of aldose reductase activity in the eye by localized magnetic resonance spectroscopy.	Journal of ocular pharmacology and therapeutics : the official journal of the Association for Ocular Pharmacology and Therapeutics 20011001