3,3,4,4-tetrafluoro-1-iodo-2-(3,3,4,4-tetrafluoro-2-iodocyclobuten-1-yl)cyclobutene

C8F8I2 — CID 10649104

IUPAC3,3,4,4-tetrafluoro-1-iodo-2-(3,3,4,4-tetrafluoro-2-iodocyclobuten-1-yl)cyclobutene
SMILESFC1(F)C(I)=C(C2=C(I)C(F)(F)C2(F)F)C1(F)F
InChIInChI=1S/C8F8I2/c9-5(10)1(3(17)7(5,13)14)2-4(18)8(15,16)6(2,11)12
InChIKeyHTIIOHDDXAFNDG-UHFFFAOYSA-N
MW501.88 g/mol
LogP4.93
Rot. Bonds1

About 3,3,4,4-tetrafluoro-1-iodo-2-(3,3,4,4-tetrafluoro-2-iodocyclobuten-1-yl)cyclobutene

3,3,4,4-tetrafluoro-1-iodo-2-(3,3,4,4-tetrafluoro-2-iodocyclobuten-1-yl)cyclobutene (PubChem CID 10649104) has the molecular formula C8F8I2 and a molecular weight of 501.88 g/mol. Its IUPAC name is 3,3,4,4-tetrafluoro-1-iodo-2-(3,3,4,4-tetrafluoro-2-iodocyclobuten-1-yl)cyclobutene.

Molecular Properties

Compound Name3,3,4,4-tetrafluoro-1-iodo-2-(3,3,4,4-tetrafluoro-2-iodocyclobuten-1-yl)cyclobutene
PubChem CID10649104
Molecular FormulaC8F8I2
Molecular Weight501.88 g/mol
Exact Mass501.80
IUPAC Name3,3,4,4-tetrafluoro-1-iodo-2-(3,3,4,4-tetrafluoro-2-iodocyclobuten-1-yl)cyclobutene
SMILESFC1(F)C(I)=C(C2=C(I)C(F)(F)C2(F)F)C1(F)F
InChIInChI=1S/C8F8I2/c9-5(10)1(3(17)7(5,13)14)2-4(18)8(15,16)6(2,11)12
InChIKeyHTIIOHDDXAFNDG-UHFFFAOYSA-N
XLogP4.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500501.88
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Deca-fluoro-1,1-bi(cyclobutene)
CID 14664213
3,3,4,4,5,5-Hexafluoro-1-(3,3,4,4,5,5-hexafluoro-2-iodocyclopenten-1-yl)-2-iodocyclopentene
CID 10579496
3,3,4,4-Tetrafluoro-1,2-bis(3,3,4,4-tetrafluoro-2-iodocyclobuten-1-yl)cyclobutene
CID 21731918

Frequently Asked Questions

What is the IUPAC name of 3,3,4,4-tetrafluoro-1-iodo-2-(3,3,4,4-tetrafluoro-2-iodocyclobuten-1-yl)cyclobutene?
The IUPAC name of 3,3,4,4-tetrafluoro-1-iodo-2-(3,3,4,4-tetrafluoro-2-iodocyclobuten-1-yl)cyclobutene (CID 10649104) is 3,3,4,4-tetrafluoro-1-iodo-2-(3,3,4,4-tetrafluoro-2-iodocyclobuten-1-yl)cyclobutene.
What is the SMILES notation for 3,3,4,4-tetrafluoro-1-iodo-2-(3,3,4,4-tetrafluoro-2-iodocyclobuten-1-yl)cyclobutene?
The canonical SMILES for 3,3,4,4-tetrafluoro-1-iodo-2-(3,3,4,4-tetrafluoro-2-iodocyclobuten-1-yl)cyclobutene is FC1(F)C(I)=C(C2=C(I)C(F)(F)C2(F)F)C1(F)F.
What is the InChIKey of 3,3,4,4-tetrafluoro-1-iodo-2-(3,3,4,4-tetrafluoro-2-iodocyclobuten-1-yl)cyclobutene?
The InChIKey is HTIIOHDDXAFNDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8F8I2/c9-5(10)1(3(17)7(5,13)14)2-4(18)8(15,16)6(2,11)12.
What are the key properties of 3,3,4,4-tetrafluoro-1-iodo-2-(3,3,4,4-tetrafluoro-2-iodocyclobuten-1-yl)cyclobutene?
3,3,4,4-tetrafluoro-1-iodo-2-(3,3,4,4-tetrafluoro-2-iodocyclobuten-1-yl)cyclobutene has a molecular weight of 501.88 g/mol, XLogP of 4.93, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,4,4-tetrafluoro-1-iodo-2-(3,3,4,4-tetrafluoro-2-iodocyclobuten-1-yl)cyclobutene is sourced from PubChem (CID 10649104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).