bis(5-fluorothiophen-2-yl)iodanium

C8H4F2IS2+ — CID 139728890

IUPACbis(5-fluorothiophen-2-yl)iodanium
SMILESFc1ccc([I+]c2ccc(F)s2)s1
InChIInChI=1S/C8H4F2IS2/c9-5-1-3-7(12-5)11-8-4-2-6(10)13-8/h1-4H/q+1
InChIKeyLRRLCQTVIGKMHU-UHFFFAOYSA-N
MW329.15 g/mol
LogP0.22
Rot. Bonds2

About bis(5-fluorothiophen-2-yl)iodanium

bis(5-fluorothiophen-2-yl)iodanium (PubChem CID 139728890) has the molecular formula C8H4F2IS2+ and a molecular weight of 329.15 g/mol. Its IUPAC name is bis(5-fluorothiophen-2-yl)iodanium.

Molecular Properties

Compound Namebis(5-fluorothiophen-2-yl)iodanium
PubChem CID139728890
Molecular FormulaC8H4F2IS2+
Molecular Weight329.15 g/mol
Exact Mass328.88
IUPAC Namebis(5-fluorothiophen-2-yl)iodanium
SMILESFc1ccc([I+]c2ccc(F)s2)s1
InChIInChI=1S/C8H4F2IS2/c9-5-1-3-7(12-5)11-8-4-2-6(10)13-8/h1-4H/q+1
InChIKeyLRRLCQTVIGKMHU-UHFFFAOYSA-N
XLogP0.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.15
LogP ≤ 50.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(5-fluorothiophen-2-yl)iodanium?
The IUPAC name of bis(5-fluorothiophen-2-yl)iodanium (CID 139728890) is bis(5-fluorothiophen-2-yl)iodanium.
What is the SMILES notation for bis(5-fluorothiophen-2-yl)iodanium?
The canonical SMILES for bis(5-fluorothiophen-2-yl)iodanium is Fc1ccc([I+]c2ccc(F)s2)s1.
What is the InChIKey of bis(5-fluorothiophen-2-yl)iodanium?
The InChIKey is LRRLCQTVIGKMHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4F2IS2/c9-5-1-3-7(12-5)11-8-4-2-6(10)13-8/h1-4H/q+1.
What are the key properties of bis(5-fluorothiophen-2-yl)iodanium?
bis(5-fluorothiophen-2-yl)iodanium has a molecular weight of 329.15 g/mol, XLogP of 0.22, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(5-fluorothiophen-2-yl)iodanium is sourced from PubChem (CID 139728890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).