GlyTouCan:G21349BB
Basic information
- CAS
74554-11-3- Standard SMILES
C[C@@H]1OC(O)[C@@H](F)[C@H](O)[C@@H]1O- InChIKey
IRKXGKIPOMIQOD-ZZWDRFIYSA-N- Molecular formula
- C6H11FO4
- Average molar mass
- 166.15 g/mol
- Monoisotopic mass
- 166.06413699
Names & identifiers
- Preferred name
- GlyTouCan:G21349BB
- IUPAC
- (3S,4R,5S,6S)-3-fluoro-6-methyloxane-2,4,5-triol
- English name
- (3S,4R,5S,6S)-3-fluoro-6-methyloxane-2,4,5-triol
- Molecular formula
- C6H11FO4
- Molecular weight
- 166.15
Names & synonyms
RefChem:401529GlyTouCan:G21349BBG21349BB2089647-47-0(3S,4R,5S,6S)-3-Fluoro-6-methyltetrahydro-2H-pyran-2,4,5-triolMFCD08457748(3S,4R,5S,6S)-3-fluoro-6-methyloxane-2,4,5-triolrel-(3S,4R,5S,6S)-3-Fluoro-6-methyltetrahydro-2H-pyran-2,4,5-triol(3S,4R,5S,6S)-3-Fluoro-6-methyl-tetrahydropyran-2,4,5-triol2369960-60-92-Fluoro-L-fucosestarbld0000872
Show more names
3-Fluoro-6-methyloxane-2,4,5-triol2,6-Dideoxy-2-fluoro-L-galactopyranose (α,β Mixture)
2-fluorofucose( SGN-2FF)orb1309107SCHEMBL31745144SGN-2FF S9954SGN-2FF, 10 mM in DMSOGLXC-27446EX-A5831NSC803552
Database identifiers
- CAS
74554-11-3- PubChem CID
- 44544736
Properties
Computed structural properties
- XLogP
- -1.1
- Topological polar surface area
- 69.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 143
Physicochemical properties
- Boiling point
- 323.653 · 323.653±42.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.423 · 1.423±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 11.637 · 11.637±0.70(predicted)
- FDA UNII
- 455 XL5ISU5 · 455XL5ISU5
Chemistry & industry
Applications
Uses2,6-Dideoxy-2-fluoro-L-galactopyranose (α,β Mixture) is used in the preparation of GDP-2-deoxy-2-fluoro-β-L-fucose, a human α-1,3-fucosyltransferase V inhibitor.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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