2-(difluoromethyl)-5-hydroxypyridine-4-sulfonyl chloride

C6H4ClF2NO3S — CID 118804023

IUPAC2-(difluoromethyl)-5-hydroxypyridine-4-sulfonyl chloride
SMILESO=S(=O)(Cl)c1cc(C(F)F)ncc1O
InChIInChI=1S/C6H4ClF2NO3S/c7-14(12,13)5-1-3(6(8)9)10-2-4(5)11/h1-2,6,11H
InChIKeyVDKFEVCEMCIKEY-UHFFFAOYSA-N
MW243.62 g/mol
LogP1.65
Rot. Bonds2

About 2-(difluoromethyl)-5-hydroxypyridine-4-sulfonyl chloride

2-(difluoromethyl)-5-hydroxypyridine-4-sulfonyl chloride (PubChem CID 118804023) has the molecular formula C6H4ClF2NO3S and a molecular weight of 243.62 g/mol. Its IUPAC name is 2-(difluoromethyl)-5-hydroxypyridine-4-sulfonyl chloride.

Molecular Properties

Compound Name2-(difluoromethyl)-5-hydroxypyridine-4-sulfonyl chloride
PubChem CID118804023
Molecular FormulaC6H4ClF2NO3S
Molecular Weight243.62 g/mol
Exact Mass242.96
IUPAC Name2-(difluoromethyl)-5-hydroxypyridine-4-sulfonyl chloride
SMILESO=S(=O)(Cl)c1cc(C(F)F)ncc1O
InChIInChI=1S/C6H4ClF2NO3S/c7-14(12,13)5-1-3(6(8)9)10-2-4(5)11/h1-2,6,11H
InChIKeyVDKFEVCEMCIKEY-UHFFFAOYSA-N
XLogP1.65
TPSA67.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.62
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-2-(difluoromethyl)pyridine-4-sulfonyl chloride
CID 130095758
5-amino-2-(difluoromethyl)pyridine-4-sulfonyl chloride
CID 130094958
5-chloro-2-(difluoromethyl)pyridine-4-sulfonamide
CID 130095776
5-bromo-2-(difluoromethyl)pyridine-4-sulfonamide
CID 130095357
4-chloro-6-(difluoromethyl)pyridine-3-sulfonamide
CID 130095772
6-(difluoromethyl)-4-iodopyridine-3-sulfonamide
CID 118842909
3-chloro-6-(difluoromethyl)-2-methylpyridine-4-sulfonyl chloride
CID 130074580
5-(difluoromethyl)-2-fluoropyridine-4-sulfonyl chloride
CID 130096580
6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonyl chloride
CID 130105042
3-(difluoromethyl)-5-hydroxy-2-iodopyridine-4-sulfonyl chloride
CID 130083037
2-(difluoromethyl)-5-hydroxy-4-iodopyridine-3-sulfonyl chloride
CID 118854704
5-chloro-2-(difluoromethyl)pyridine-3-sulfonyl chloride
CID 130095757

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-5-hydroxypyridine-4-sulfonyl chloride?
The IUPAC name of 2-(difluoromethyl)-5-hydroxypyridine-4-sulfonyl chloride (CID 118804023) is 2-(difluoromethyl)-5-hydroxypyridine-4-sulfonyl chloride.
What is the SMILES notation for 2-(difluoromethyl)-5-hydroxypyridine-4-sulfonyl chloride?
The canonical SMILES for 2-(difluoromethyl)-5-hydroxypyridine-4-sulfonyl chloride is O=S(=O)(Cl)c1cc(C(F)F)ncc1O.
What is the InChIKey of 2-(difluoromethyl)-5-hydroxypyridine-4-sulfonyl chloride?
The InChIKey is VDKFEVCEMCIKEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4ClF2NO3S/c7-14(12,13)5-1-3(6(8)9)10-2-4(5)11/h1-2,6,11H.
What are the key properties of 2-(difluoromethyl)-5-hydroxypyridine-4-sulfonyl chloride?
2-(difluoromethyl)-5-hydroxypyridine-4-sulfonyl chloride has a molecular weight of 243.62 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-5-hydroxypyridine-4-sulfonyl chloride is sourced from PubChem (CID 118804023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).