2,3,4,6-Tetra-O-acetyl-D-mannopyranosyl Fluoride
Basic information
- CAS
174511-17-2- Standard SMILES
CC(=O)OCC1OC(F)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O- InChIKey
JJXATNWYELAACC-UHFFFAOYSA-N- Molecular formula
- C14H19FO9
- Average molar mass
- 350.29 g/mol
- Monoisotopic mass
- 350.10131034
Names & identifiers
- Preferred name
- 2,3,4,6-Tetra-O-acetyl-D-mannopyranosyl Fluoride
- IUPAC
- (3,4,5-triacetyloxy-6-fluorooxan-2-yl)methyl acetate
- English name
- 2,3,4,6-Tetra-O-acetyl-D-mannopyranosyl fluoride
- Molecular formula
- C14H19FO9
- Molecular weight
- 350.29
Names & synonyms
2,3,4,6-Tetra-O-acetyl-D-mannopyranosyl FluorideDTXSID30337119RefChem:243925DTXCID20288207174511-17-2(2R,3R,4S,5S,6R)-2-(Acetoxymethyl)-6-fluorotetrahydro-2H-pyran-3,4,5-triyl triacetate2,3,4,6-Tetra-O-acetyl-?-D-glucopyranosyl fluoride(3,4,5-triacetyloxy-6-fluorooxan-2-yl)methyl acetate[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-fluorooxan-2-yl]methyl acetatetetra-o-acetyl-alpha-d-mannopyranosyl fluorideAcetofluoro-a-D-glucose[(2R,3R,4S,5S)-3,4,5-triacetyloxy-6-fluorooxan-2-yl]methyl acetate
Show more names
D-Mannopyranosyl fluoride, 2,3,4,6-tetraacetate2,3,4,6-Tetra-O-acetyl-D-mannopyranosyl Fluoride, >95.0%(GC)acetic acid (3,4,5-triacetyloxy-6-fluoro-2-oxanyl)methyl ester(2R,3R,4S,5S)-2-(Acetoxymethyl)-6-fluorotetrahydro-2H-pyran-3,4,5-triyl triacetate
SCHEMBL21021147[(2R,3R,4S,5S)-3,4,5-TRIS(ACETYLOXY)-6-FLUOROOXAN-2-YL]METHYL ACETATEJJXATNWYELAACC-UHFFFAOYSA-NCAR-22001CAR-22002CAR-22003AKOS025294725SB48299
Database identifiers
- CAS
174511-17-2- PubChem CID
- 538808
- DTXSID
DTXSID30337119
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 506
Physicochemical properties
- Boiling point
- 374.849 · 374.849±42.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.309 · 1.309±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- form
- powder to crystal
- color
- White to Almost white
- HS Code
- 2940 · 2940.00.6000
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2940.00.6000
Chemistry & industry
Applications
Uses2,3,4,6-Tetra-O-acetyl-D-mannopyranosyl Fluoride is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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