(2R,3R)-2-fluoro-3-iodooxane

C5H8FIO — CID 23236908

IUPAC(2R,3R)-2-fluoro-3-iodooxane
SMILESF[C@H]1OCCC[C@H]1I
InChIInChI=1S/C5H8FIO/c6-5-4(7)2-1-3-8-5/h4-5H,1-3H2/t4-,5+/m1/s1
InChIKeyNAGPDXICGINQLP-UHNVWZDZSA-N
MW230.02 g/mol
LogP1.90
Rot. Bonds

About (2R,3R)-2-fluoro-3-iodooxane

(2R,3R)-2-fluoro-3-iodooxane (PubChem CID 23236908) has the molecular formula C5H8FIO and a molecular weight of 230.02 g/mol. Its IUPAC name is (2R,3R)-2-fluoro-3-iodooxane.

Molecular Properties

Compound Name(2R,3R)-2-fluoro-3-iodooxane
PubChem CID23236908
Molecular FormulaC5H8FIO
Molecular Weight230.02 g/mol
Exact Mass229.96
IUPAC Name(2R,3R)-2-fluoro-3-iodooxane
SMILESF[C@H]1OCCC[C@H]1I
InChIInChI=1S/C5H8FIO/c6-5-4(7)2-1-3-8-5/h4-5H,1-3H2/t4-,5+/m1/s1
InChIKeyNAGPDXICGINQLP-UHNVWZDZSA-N
XLogP1.90
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.02
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2R,3R)-2-fluoro-3-iodooxane?
The IUPAC name of (2R,3R)-2-fluoro-3-iodooxane (CID 23236908) is (2R,3R)-2-fluoro-3-iodooxane.
What is the SMILES notation for (2R,3R)-2-fluoro-3-iodooxane?
The canonical SMILES for (2R,3R)-2-fluoro-3-iodooxane is F[C@H]1OCCC[C@H]1I.
What is the InChIKey of (2R,3R)-2-fluoro-3-iodooxane?
The InChIKey is NAGPDXICGINQLP-UHNVWZDZSA-N. The full InChI is InChI=1S/C5H8FIO/c6-5-4(7)2-1-3-8-5/h4-5H,1-3H2/t4-,5+/m1/s1.
What are the key properties of (2R,3R)-2-fluoro-3-iodooxane?
(2R,3R)-2-fluoro-3-iodooxane has a molecular weight of 230.02 g/mol, XLogP of 1.90, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-2-fluoro-3-iodooxane is sourced from PubChem (CID 23236908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).