thiophene-2-(18F)sulfonyl fluoride

C4H3FO2S2 — CID 72736656

IUPACthiophene-2-(18F)sulfonyl fluoride
SMILESO=S(=O)([18F])c1cccs1
InChIInChI=1S/C4H3FO2S2/c5-9(6,7)4-2-1-3-8-4/h1-3H/i5-1
InChIKeyNYJIUCJXMLNPHU-SFIIULIVSA-N
MW165.20 g/mol
LogP1.41
Rot. Bonds1

About thiophene-2-(18F)sulfonyl fluoride

thiophene-2-(18F)sulfonyl fluoride (PubChem CID 72736656) has the molecular formula C4H3FO2S2 and a molecular weight of 165.20 g/mol. Its IUPAC name is thiophene-2-(18F)sulfonyl fluoride.

Molecular Properties

Compound Namethiophene-2-(18F)sulfonyl fluoride
PubChem CID72736656
Molecular FormulaC4H3FO2S2
Molecular Weight165.20 g/mol
Exact Mass164.96
IUPAC Namethiophene-2-(18F)sulfonyl fluoride
SMILESO=S(=O)([18F])c1cccs1
InChIInChI=1S/C4H3FO2S2/c5-9(6,7)4-2-1-3-8-4/h1-3H/i5-1
InChIKeyNYJIUCJXMLNPHU-SFIIULIVSA-N
XLogP1.41
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-thiophen-2-ylsulfonylsulfonylthiophene
CID 141485126
N-fluorothiophene-2-sulfonamide
CID 175398216
2-(difluoromethylsulfonyl)thiophene
CID 82076235
sodium thiophene-2-sulfonic acid
CID 54603046
2-(disulfanylsulfonyl)thiophene
CID 147186470
methyl thiophene-2-sulfonate
CID 56986285
ethane;thiophene-2-sulfonyl chloride
CID 91564390
N-ethylidenethiophene-2-sulfonamide
CID 141046508
methanol;thiophene-2-sulfonamide
CID 157397427
2-propan-2-ylsulfonylthiophene
CID 22953694
N-sulfonylthiophene-2-sulfonamide
CID 88522112
N'-hydroxythiophene-2-sulfonohydrazide
CID 67151955

Frequently Asked Questions

What is the IUPAC name of thiophene-2-(18F)sulfonyl fluoride?
The IUPAC name of thiophene-2-(18F)sulfonyl fluoride (CID 72736656) is thiophene-2-(18F)sulfonyl fluoride.
What is the SMILES notation for thiophene-2-(18F)sulfonyl fluoride?
The canonical SMILES for thiophene-2-(18F)sulfonyl fluoride is O=S(=O)([18F])c1cccs1.
What is the InChIKey of thiophene-2-(18F)sulfonyl fluoride?
The InChIKey is NYJIUCJXMLNPHU-SFIIULIVSA-N. The full InChI is InChI=1S/C4H3FO2S2/c5-9(6,7)4-2-1-3-8-4/h1-3H/i5-1.
What are the key properties of thiophene-2-(18F)sulfonyl fluoride?
thiophene-2-(18F)sulfonyl fluoride has a molecular weight of 165.20 g/mol, XLogP of 1.41, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for thiophene-2-(18F)sulfonyl fluoride is sourced from PubChem (CID 72736656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).