1,1,2,2-tetrafluorobutyl hypoiodite

C4H5F4IO — CID 122591445

IUPAC1,1,2,2-tetrafluorobutyl hypoiodite
SMILESCCC(F)(F)C(F)(F)OI
InChIInChI=1S/C4H5F4IO/c1-2-3(5,6)4(7,8)10-9/h2H2,1H3
InChIKeyCDSBGIZJSFWNIP-UHFFFAOYSA-N
MW271.98 g/mol
LogP2.99
Rot. Bonds3

About 1,1,2,2-tetrafluorobutyl hypoiodite

1,1,2,2-tetrafluorobutyl hypoiodite (PubChem CID 122591445) has the molecular formula C4H5F4IO and a molecular weight of 271.98 g/mol. Its IUPAC name is 1,1,2,2-tetrafluorobutyl hypoiodite.

Molecular Properties

Compound Name1,1,2,2-tetrafluorobutyl hypoiodite
PubChem CID122591445
Molecular FormulaC4H5F4IO
Molecular Weight271.98 g/mol
Exact Mass271.93
IUPAC Name1,1,2,2-tetrafluorobutyl hypoiodite
SMILESCCC(F)(F)C(F)(F)OI
InChIInChI=1S/C4H5F4IO/c1-2-3(5,6)4(7,8)10-9/h2H2,1H3
InChIKeyCDSBGIZJSFWNIP-UHFFFAOYSA-N
XLogP2.99
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.98
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1,2,2-tetrafluorobutyl hypoiodite?
The IUPAC name of 1,1,2,2-tetrafluorobutyl hypoiodite (CID 122591445) is 1,1,2,2-tetrafluorobutyl hypoiodite.
What is the SMILES notation for 1,1,2,2-tetrafluorobutyl hypoiodite?
The canonical SMILES for 1,1,2,2-tetrafluorobutyl hypoiodite is CCC(F)(F)C(F)(F)OI.
What is the InChIKey of 1,1,2,2-tetrafluorobutyl hypoiodite?
The InChIKey is CDSBGIZJSFWNIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5F4IO/c1-2-3(5,6)4(7,8)10-9/h2H2,1H3.
What are the key properties of 1,1,2,2-tetrafluorobutyl hypoiodite?
1,1,2,2-tetrafluorobutyl hypoiodite has a molecular weight of 271.98 g/mol, XLogP of 2.99, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2-tetrafluorobutyl hypoiodite is sourced from PubChem (CID 122591445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).