4-fluorosulfonyloxypyridine

C5H4FNO3S — CID 86171970

IUPAC4-fluorosulfonyloxypyridine
SMILESO=S(=O)(F)Oc1ccncc1
InChIInChI=1S/C5H4FNO3S/c6-11(8,9)10-5-1-3-7-4-2-5/h1-4H
InChIKeyKECQXYPHUJRHKH-UHFFFAOYSA-N
MW177.16 g/mol
LogP0.67
Rot. Bonds2

About 4-fluorosulfonyloxypyridine

4-fluorosulfonyloxypyridine (PubChem CID 86171970) has the molecular formula C5H4FNO3S and a molecular weight of 177.16 g/mol. Its IUPAC name is 4-fluorosulfonyloxypyridine.

Molecular Properties

Compound Name4-fluorosulfonyloxypyridine
PubChem CID86171970
Molecular FormulaC5H4FNO3S
Molecular Weight177.16 g/mol
Exact Mass176.99
IUPAC Name4-fluorosulfonyloxypyridine
SMILESO=S(=O)(F)Oc1ccncc1
InChIInChI=1S/C5H4FNO3S/c6-11(8,9)10-5-1-3-7-4-2-5/h1-4H
InChIKeyKECQXYPHUJRHKH-UHFFFAOYSA-N
XLogP0.67
TPSA56.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.16
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-fluorosulfonyloxypyridine?
The IUPAC name of 4-fluorosulfonyloxypyridine (CID 86171970) is 4-fluorosulfonyloxypyridine.
What is the SMILES notation for 4-fluorosulfonyloxypyridine?
The canonical SMILES for 4-fluorosulfonyloxypyridine is O=S(=O)(F)Oc1ccncc1.
What is the InChIKey of 4-fluorosulfonyloxypyridine?
The InChIKey is KECQXYPHUJRHKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4FNO3S/c6-11(8,9)10-5-1-3-7-4-2-5/h1-4H.
What are the key properties of 4-fluorosulfonyloxypyridine?
4-fluorosulfonyloxypyridine has a molecular weight of 177.16 g/mol, XLogP of 0.67, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluorosulfonyloxypyridine is sourced from PubChem (CID 86171970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).