2-fluorobenzenesulfonyl iodide

C6H4FIO2S — CID 23452806

IUPAC2-fluorobenzenesulfonyl iodide
SMILESO=S(=O)(I)c1ccccc1F
InChIInChI=1S/C6H4FIO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H
InChIKeyHSLCCPZQZBREJX-UHFFFAOYSA-N
MW286.06 g/mol
LogP1.95
Rot. Bonds1

About 2-fluorobenzenesulfonyl iodide

2-fluorobenzenesulfonyl iodide (PubChem CID 23452806) has the molecular formula C6H4FIO2S and a molecular weight of 286.06 g/mol. Its IUPAC name is 2-fluorobenzenesulfonyl iodide.

Molecular Properties

Compound Name2-fluorobenzenesulfonyl iodide
PubChem CID23452806
Molecular FormulaC6H4FIO2S
Molecular Weight286.06 g/mol
Exact Mass285.90
IUPAC Name2-fluorobenzenesulfonyl iodide
SMILESO=S(=O)(I)c1ccccc1F
InChIInChI=1S/C6H4FIO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H
InChIKeyHSLCCPZQZBREJX-UHFFFAOYSA-N
XLogP1.95
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.06
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

benzene;2-fluorobenzenesulfonic acid
CID 174946544
lithium;2-fluorobenzenesulfonate;trifluoroborane
CID 160988464
1-fluoro-2-(trifluoromethylsulfonyl)benzene;ruthenium
CID 159777789
(2-fluorophenyl)-methyl-methylimino-oxo-λ6-sulfane
CID 125424706
(2-fluorophenyl)-imino-oxo-(trifluoromethyl)-λ6-sulfane
CID 132598581
1-(2-fluorophenyl)sulfonylnaphthalene
CID 141142216
2-(2-fluorophenyl)sulfonyl-2-methylpropanal
CID 115037670
2-chlorobenzenesulfonic acid;2-fluorobenzenesulfonic acid
CID 161100557
2-fluoro-1-(2-fluorophenyl)sulfonyl-4-methylbenzene
CID 162721199
2-fluorobenzenesulfonate;triphenylsulfanium
CID 22481386
[[(2-fluorophenyl)-methyl-oxo-λ6-sulfanylidene]amino]-trimethylsilane
CID 170607338
N-[(2-fluorophenyl)-methylidene-oxo-λ6-sulfanyl]methanamine;propane
CID 142042743

Frequently Asked Questions

What is the IUPAC name of 2-fluorobenzenesulfonyl iodide?
The IUPAC name of 2-fluorobenzenesulfonyl iodide (CID 23452806) is 2-fluorobenzenesulfonyl iodide.
What is the SMILES notation for 2-fluorobenzenesulfonyl iodide?
The canonical SMILES for 2-fluorobenzenesulfonyl iodide is O=S(=O)(I)c1ccccc1F.
What is the InChIKey of 2-fluorobenzenesulfonyl iodide?
The InChIKey is HSLCCPZQZBREJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4FIO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H.
What are the key properties of 2-fluorobenzenesulfonyl iodide?
2-fluorobenzenesulfonyl iodide has a molecular weight of 286.06 g/mol, XLogP of 1.95, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluorobenzenesulfonyl iodide is sourced from PubChem (CID 23452806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).