6-phenoxypyridine-3-sulfonyl chloride

C11H8ClNO3S — CID 2776499

IUPAC6-phenoxypyridine-3-sulfonyl chloride
SMILESO=S(=O)(Cl)c1ccc(Oc2ccccc2)nc1
InChIInChI=1S/C11H8ClNO3S/c12-17(14,15)10-6-7-11(13-8-10)16-9-4-2-1-3-5-9/h1-8H
InChIKeyAHTIUBWJNYRYLG-UHFFFAOYSA-N
MW269.71 g/mol
LogP2.80
Rot. Bonds3

About 6-phenoxypyridine-3-sulfonyl chloride

6-phenoxypyridine-3-sulfonyl chloride (PubChem CID 2776499) has the molecular formula C11H8ClNO3S and a molecular weight of 269.71 g/mol. Its IUPAC name is 6-phenoxypyridine-3-sulfonyl chloride.

Molecular Properties

Compound Name6-phenoxypyridine-3-sulfonyl chloride
PubChem CID2776499
Molecular FormulaC11H8ClNO3S
Molecular Weight269.71 g/mol
Exact Mass268.99
IUPAC Name6-phenoxypyridine-3-sulfonyl chloride
SMILESO=S(=O)(Cl)c1ccc(Oc2ccccc2)nc1
InChIInChI=1S/C11H8ClNO3S/c12-17(14,15)10-6-7-11(13-8-10)16-9-4-2-1-3-5-9/h1-8H
InChIKeyAHTIUBWJNYRYLG-UHFFFAOYSA-N
XLogP2.80
TPSA56.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.71
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-phenoxypyridine-3-sulfonyl chloride?
The IUPAC name of 6-phenoxypyridine-3-sulfonyl chloride (CID 2776499) is 6-phenoxypyridine-3-sulfonyl chloride.
What is the SMILES notation for 6-phenoxypyridine-3-sulfonyl chloride?
The canonical SMILES for 6-phenoxypyridine-3-sulfonyl chloride is O=S(=O)(Cl)c1ccc(Oc2ccccc2)nc1.
What is the InChIKey of 6-phenoxypyridine-3-sulfonyl chloride?
The InChIKey is AHTIUBWJNYRYLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClNO3S/c12-17(14,15)10-6-7-11(13-8-10)16-9-4-2-1-3-5-9/h1-8H.
What are the key properties of 6-phenoxypyridine-3-sulfonyl chloride?
6-phenoxypyridine-3-sulfonyl chloride has a molecular weight of 269.71 g/mol, XLogP of 2.80, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenoxypyridine-3-sulfonyl chloride is sourced from PubChem (CID 2776499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).