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

C6H11FO4 — CID 23234519

IUPAC(2R,3R,4R,5R,6S)-3-fluoro-6-methyloxane-2,4,5-triol
SMILESC[C@@H]1O[C@@H](O)[C@H](F)[C@H](O)[C@H]1O
InChIInChI=1S/C6H11FO4/c1-2-4(8)5(9)3(7)6(10)11-2/h2-6,8-10H,1H3/t2-,3+,4-,5-,6+/m0/s1
InChIKeyIRKXGKIPOMIQOD-BYIBVSMXSA-N
MW166.15 g/mol
LogP-1.22
Rot. Bonds

About (2R,3R,4R,5R,6S)-3-fluoro-6-methyloxane-2,4,5-triol

(2R,3R,4R,5R,6S)-3-fluoro-6-methyloxane-2,4,5-triol (PubChem CID 23234519) has the molecular formula C6H11FO4 and a molecular weight of 166.15 g/mol. Its IUPAC name is (2R,3R,4R,5R,6S)-3-fluoro-6-methyloxane-2,4,5-triol.

Molecular Properties

Compound Name(2R,3R,4R,5R,6S)-3-fluoro-6-methyloxane-2,4,5-triol
PubChem CID23234519
Molecular FormulaC6H11FO4
Molecular Weight166.15 g/mol
Exact Mass166.06
IUPAC Name(2R,3R,4R,5R,6S)-3-fluoro-6-methyloxane-2,4,5-triol
SMILESC[C@@H]1O[C@@H](O)[C@H](F)[C@H](O)[C@H]1O
InChIInChI=1S/C6H11FO4/c1-2-4(8)5(9)3(7)6(10)11-2/h2-6,8-10H,1H3/t2-,3+,4-,5-,6+/m0/s1
InChIKeyIRKXGKIPOMIQOD-BYIBVSMXSA-N
XLogP-1.22
TPSA69.92 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.15
LogP ≤ 5-1.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze (2R,3R,4R,5R,6S)-3-fluoro-6-methyloxane-2,4,5-triol with MolForge

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Related Compounds

D-Glucose
CID 5793
D-Fructose
CID 2723872
D-Xylose
CID 135191
D-Tagatose
CID 439312
D-Galactose
CID 6036
Hexose
CID 206
Beta-D-Glucose
CID 64689
beta-L-arabinopyranose
CID 439764
L-Fucose
CID 17106
Beta-D-Fructopyranose
CID 24310
beta-D-Galactopyranose
CID 439353
D-Ribose
CID 10975657

Frequently Asked Questions

What is the IUPAC name of (2R,3R,4R,5R,6S)-3-fluoro-6-methyloxane-2,4,5-triol?
The IUPAC name of (2R,3R,4R,5R,6S)-3-fluoro-6-methyloxane-2,4,5-triol (CID 23234519) is (2R,3R,4R,5R,6S)-3-fluoro-6-methyloxane-2,4,5-triol.
What is the SMILES notation for (2R,3R,4R,5R,6S)-3-fluoro-6-methyloxane-2,4,5-triol?
The canonical SMILES for (2R,3R,4R,5R,6S)-3-fluoro-6-methyloxane-2,4,5-triol is C[C@@H]1O[C@@H](O)[C@H](F)[C@H](O)[C@H]1O.
What is the InChIKey of (2R,3R,4R,5R,6S)-3-fluoro-6-methyloxane-2,4,5-triol?
The InChIKey is IRKXGKIPOMIQOD-BYIBVSMXSA-N. The full InChI is InChI=1S/C6H11FO4/c1-2-4(8)5(9)3(7)6(10)11-2/h2-6,8-10H,1H3/t2-,3+,4-,5-,6+/m0/s1.
What are the key properties of (2R,3R,4R,5R,6S)-3-fluoro-6-methyloxane-2,4,5-triol?
(2R,3R,4R,5R,6S)-3-fluoro-6-methyloxane-2,4,5-triol has a molecular weight of 166.15 g/mol, XLogP of -1.22, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R,4R,5R,6S)-3-fluoro-6-methyloxane-2,4,5-triol is sourced from PubChem (CID 23234519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).