3-fluorothiophene-2-sulfonyl chloride

C4H2ClFO2S2 — CID 15158653

IUPAC3-fluorothiophene-2-sulfonyl chloride
SMILESO=S(=O)(Cl)c1sccc1F
InChIInChI=1S/C4H2ClFO2S2/c5-10(7,8)4-3(6)1-2-9-4/h1-2H
InChIKeyPEWHQVBNUDXLMB-UHFFFAOYSA-N
MW200.64 g/mol
LogP1.81
Rot. Bonds1

About 3-fluorothiophene-2-sulfonyl chloride

3-fluorothiophene-2-sulfonyl chloride (PubChem CID 15158653) has the molecular formula C4H2ClFO2S2 and a molecular weight of 200.64 g/mol. Its IUPAC name is 3-fluorothiophene-2-sulfonyl chloride.

Molecular Properties

Compound Name3-fluorothiophene-2-sulfonyl chloride
PubChem CID15158653
Molecular FormulaC4H2ClFO2S2
Molecular Weight200.64 g/mol
Exact Mass199.92
IUPAC Name3-fluorothiophene-2-sulfonyl chloride
SMILESO=S(=O)(Cl)c1sccc1F
InChIInChI=1S/C4H2ClFO2S2/c5-10(7,8)4-3(6)1-2-9-4/h1-2H
InChIKeyPEWHQVBNUDXLMB-UHFFFAOYSA-N
XLogP1.81
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.64
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-fluorothiophene-2-sulfonyl chloride?
The IUPAC name of 3-fluorothiophene-2-sulfonyl chloride (CID 15158653) is 3-fluorothiophene-2-sulfonyl chloride.
What is the SMILES notation for 3-fluorothiophene-2-sulfonyl chloride?
The canonical SMILES for 3-fluorothiophene-2-sulfonyl chloride is O=S(=O)(Cl)c1sccc1F.
What is the InChIKey of 3-fluorothiophene-2-sulfonyl chloride?
The InChIKey is PEWHQVBNUDXLMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H2ClFO2S2/c5-10(7,8)4-3(6)1-2-9-4/h1-2H.
What are the key properties of 3-fluorothiophene-2-sulfonyl chloride?
3-fluorothiophene-2-sulfonyl chloride has a molecular weight of 200.64 g/mol, XLogP of 1.81, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluorothiophene-2-sulfonyl chloride is sourced from PubChem (CID 15158653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).