[(2S,3R,4R,5S)-4-fluoro-3,5-dimethyloxolan-2-yl]methyl hypoiodite

C7H12FIO2 — CID 166729505

IUPAC[(2S,3R,4R,5S)-4-fluoro-3,5-dimethyloxolan-2-yl]methyl hypoiodite
SMILESC[C@H]1[C@@H](F)[C@H](C)O[C@@H]1COI
InChIInChI=1S/C7H12FIO2/c1-4-6(3-10-9)11-5(2)7(4)8/h4-7H,3H2,1-2H3/t4-,5+,6-,7-/m1/s1
InChIKeyJGFJSIXIJRAWPZ-XZBKPIIZSA-N
MW274.07 g/mol
LogP2.11
Rot. Bonds2

About [(2S,3R,4R,5S)-4-fluoro-3,5-dimethyloxolan-2-yl]methyl hypoiodite

[(2S,3R,4R,5S)-4-fluoro-3,5-dimethyloxolan-2-yl]methyl hypoiodite (PubChem CID 166729505) has the molecular formula C7H12FIO2 and a molecular weight of 274.07 g/mol. Its IUPAC name is [(2S,3R,4R,5S)-4-fluoro-3,5-dimethyloxolan-2-yl]methyl hypoiodite.

Molecular Properties

Compound Name[(2S,3R,4R,5S)-4-fluoro-3,5-dimethyloxolan-2-yl]methyl hypoiodite
PubChem CID166729505
Molecular FormulaC7H12FIO2
Molecular Weight274.07 g/mol
Exact Mass273.99
IUPAC Name[(2S,3R,4R,5S)-4-fluoro-3,5-dimethyloxolan-2-yl]methyl hypoiodite
SMILESC[C@H]1[C@@H](F)[C@H](C)O[C@@H]1COI
InChIInChI=1S/C7H12FIO2/c1-4-6(3-10-9)11-5(2)7(4)8/h4-7H,3H2,1-2H3/t4-,5+,6-,7-/m1/s1
InChIKeyJGFJSIXIJRAWPZ-XZBKPIIZSA-N
XLogP2.11
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.07
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

[(2R,3S,4S)-3-fluoro-4,5-dimethyloxolan-2-yl]methanol
CID 57536196
[(2S,3R,4R)-4-fluoro-3,5-dimethyloxolan-2-yl]methanol
CID 57536207
CID 57693426
CID 57693426
4-Fluoro-2-(methoxymethyl)-3,5-dimethyloxolane
CID 59875108
(4-Fluoro-3,5-dimethyloxolan-2-yl)methanol
CID 76558929
[(2S,3S)-4-fluoro-3,5-dimethyloxolan-2-yl]methanol
CID 88976403
[(2S,3R)-3-(fluoromethyl)-5-methyloxolan-2-yl]methanol
CID 88976436
[(2S,3R,5S)-3-(fluoromethyl)-5-methyloxolan-2-yl]methanol
CID 88976666
[(2S,5S)-3-(fluoromethyl)-5-methyloxolan-2-yl]methanol
CID 88980025
[(2S,4S,5S)-4-(fluoromethyl)-5-methyloxolan-2-yl]methanol
CID 89078219
[(2S,3S,5S)-3-(fluoromethyl)-5-methyloxolan-2-yl]methanol
CID 118465956
[(2S,3S,5S)-4-fluoro-3,5-dimethyloxolan-2-yl]methanol
CID 140536394

Frequently Asked Questions

What is the IUPAC name of [(2S,3R,4R,5S)-4-fluoro-3,5-dimethyloxolan-2-yl]methyl hypoiodite?
The IUPAC name of [(2S,3R,4R,5S)-4-fluoro-3,5-dimethyloxolan-2-yl]methyl hypoiodite (CID 166729505) is [(2S,3R,4R,5S)-4-fluoro-3,5-dimethyloxolan-2-yl]methyl hypoiodite.
What is the SMILES notation for [(2S,3R,4R,5S)-4-fluoro-3,5-dimethyloxolan-2-yl]methyl hypoiodite?
The canonical SMILES for [(2S,3R,4R,5S)-4-fluoro-3,5-dimethyloxolan-2-yl]methyl hypoiodite is C[C@H]1[C@@H](F)[C@H](C)O[C@@H]1COI.
What is the InChIKey of [(2S,3R,4R,5S)-4-fluoro-3,5-dimethyloxolan-2-yl]methyl hypoiodite?
The InChIKey is JGFJSIXIJRAWPZ-XZBKPIIZSA-N. The full InChI is InChI=1S/C7H12FIO2/c1-4-6(3-10-9)11-5(2)7(4)8/h4-7H,3H2,1-2H3/t4-,5+,6-,7-/m1/s1.
What are the key properties of [(2S,3R,4R,5S)-4-fluoro-3,5-dimethyloxolan-2-yl]methyl hypoiodite?
[(2S,3R,4R,5S)-4-fluoro-3,5-dimethyloxolan-2-yl]methyl hypoiodite has a molecular weight of 274.07 g/mol, XLogP of 2.11, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,3R,4R,5S)-4-fluoro-3,5-dimethyloxolan-2-yl]methyl hypoiodite is sourced from PubChem (CID 166729505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).