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2-Deoxy-2-fluoro-D-mannose

CAT: 0572-TRC-D235150-25MGSize: 25 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-D235150-25MGSize:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
38440-79-8
Hazard Statement
Not a hazardous substance according to GHS.
Purity
>95% (HPLC)
Smiles
OC[C@H]1OC(O)[C@@H](F)[C@@H](O)[C@@H]1O
Molecular Formula
C6 H11 F O5
Molecular Weight
182.15
InChI
InChI=1S/C6H11FO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1H2/t2-,3+,4-,5-,6?/m1/s1
Additionnal Information
IUPAC name: (3S,4S,5S,6R)-3-fluoro-6-(hydroxymethyl)oxane-2,4,5-triol
Shipping Conditions
Dry Pack
Storage Conditions
-20°C

Chemical Information

2-Fluoro-2-deoxy-D-mannose

See also: 2-Fluoro-2-deoxy-D-glucose (annotation moved to).

CAS Number38440-79-8
PubChem CID20111867
IUPAC Name(2S,3S,4R,5R)-2-fluoro-3,4,5,6-tetrahydroxyhexanal
Molecular FormulaC6H11FO5
Molecular Weight182.15
XLogP-2.4
Topological Polar Surface Area98
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count12
Formal Charge0
Complexity142
SMILES
C([C@H]([C@H]([C@@H]([C@@H](C=O)F)O)O)O)O
InChI
InChI=1S/C6H11FO5/c7-3(1-8)5(11)6(12)4(10)2-9/h1,3-6,9-12H,2H2/t3-,4-,5-,6-/m1/s1
InChIKey
AOYNUTHNTBLRMT-KVTDHHQDSA-N
Chemical Structure
2D Structure
2D structure of 2-Fluoro-2-deoxy-D-mannose
CAS: 38440-79-8
CID: 20111867
Formula: C6H11FO5
MW: 182.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight182.15
XLogP3-2.4
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass182.05905161
Monoisotopic Mass182.05905161
Topological Polar Surface Area98 Ų
Heavy Atom Count12
Formal Charge0
Complexity142
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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