bis(4-fluoro-2-methylphenyl)iodanium

C14H12F2I+ — CID 162490198

IUPACbis(4-fluoro-2-methylphenyl)iodanium
SMILESCc1cc(F)ccc1[I+]c1ccc(F)cc1C
InChIInChI=1S/C14H12F2I/c1-9-7-11(15)3-5-13(9)17-14-6-4-12(16)8-10(14)2/h3-8H,1-2H3/q+1
InChIKeyDBQNTEKAHTXIFZ-UHFFFAOYSA-N
MW345.15 g/mol
LogP0.71
Rot. Bonds2

About bis(4-fluoro-2-methylphenyl)iodanium

bis(4-fluoro-2-methylphenyl)iodanium (PubChem CID 162490198) has the molecular formula C14H12F2I+ and a molecular weight of 345.15 g/mol. Its IUPAC name is bis(4-fluoro-2-methylphenyl)iodanium.

Molecular Properties

Compound Namebis(4-fluoro-2-methylphenyl)iodanium
PubChem CID162490198
Molecular FormulaC14H12F2I+
Molecular Weight345.15 g/mol
Exact Mass344.99
IUPAC Namebis(4-fluoro-2-methylphenyl)iodanium
SMILESCc1cc(F)ccc1[I+]c1ccc(F)cc1C
InChIInChI=1S/C14H12F2I/c1-9-7-11(15)3-5-13(9)17-14-6-4-12(16)8-10(14)2/h3-8H,1-2H3/q+1
InChIKeyDBQNTEKAHTXIFZ-UHFFFAOYSA-N
XLogP0.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.15
LogP ≤ 50.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-fluoro-2-methylphenol;zirconium
CID 174391374
4-fluoro-2-methyl-1-methylsulfanylbenzene
CID 53414601
magnesium;4-fluoro-1-methanidyl-2-methylbenzene;chloride
CID 24722704
3,6-difluoro-1-methylnaphthalene
CID 138605249
difluoro-(4-fluoro-2-methylphenyl)-λ3-iodane
CID 157382093
(4-fluoro-2-methylphenyl)-dimethylborane
CID 59420238
2,4-difluoro-1-methylbenzene;hydrobromide
CID 174767043
(2S)-2-(4-fluoro-2-methylphenyl)oxirane
CID 83129374
6-(4-fluoro-2-methylphenyl)spiro[2.5]octane
CID 177193313
ethane;4-fluoro-1-methoxy-2-methylbenzene
CID 143329013
ethane;1-ethyl-4-fluoro-2-methylbenzene
CID 143471886
4-fluoro-2-methylbenzaldehyde
CID 2783217

Frequently Asked Questions

What is the IUPAC name of bis(4-fluoro-2-methylphenyl)iodanium?
The IUPAC name of bis(4-fluoro-2-methylphenyl)iodanium (CID 162490198) is bis(4-fluoro-2-methylphenyl)iodanium.
What is the SMILES notation for bis(4-fluoro-2-methylphenyl)iodanium?
The canonical SMILES for bis(4-fluoro-2-methylphenyl)iodanium is Cc1cc(F)ccc1[I+]c1ccc(F)cc1C.
What is the InChIKey of bis(4-fluoro-2-methylphenyl)iodanium?
The InChIKey is DBQNTEKAHTXIFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2I/c1-9-7-11(15)3-5-13(9)17-14-6-4-12(16)8-10(14)2/h3-8H,1-2H3/q+1.
What are the key properties of bis(4-fluoro-2-methylphenyl)iodanium?
bis(4-fluoro-2-methylphenyl)iodanium has a molecular weight of 345.15 g/mol, XLogP of 0.71, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-fluoro-2-methylphenyl)iodanium is sourced from PubChem (CID 162490198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).