6-(difluoromethyl)-2,4-difluoropyridine-3-sulfonyl chloride

C6H2ClF4NO2S — CID 130099937

IUPAC6-(difluoromethyl)-2,4-difluoropyridine-3-sulfonyl chloride
SMILESO=S(=O)(Cl)c1c(F)cc(C(F)F)nc1F
InChIInChI=1S/C6H2ClF4NO2S/c7-15(13,14)4-2(8)1-3(5(9)10)12-6(4)11/h1,5H
InChIKeyIGUXEQRPPIQKFD-UHFFFAOYSA-N
MW263.60 g/mol
LogP2.22
Rot. Bonds2

About 6-(difluoromethyl)-2,4-difluoropyridine-3-sulfonyl chloride

6-(difluoromethyl)-2,4-difluoropyridine-3-sulfonyl chloride (PubChem CID 130099937) has the molecular formula C6H2ClF4NO2S and a molecular weight of 263.60 g/mol. Its IUPAC name is 6-(difluoromethyl)-2,4-difluoropyridine-3-sulfonyl chloride.

Molecular Properties

Compound Name6-(difluoromethyl)-2,4-difluoropyridine-3-sulfonyl chloride
PubChem CID130099937
Molecular FormulaC6H2ClF4NO2S
Molecular Weight263.60 g/mol
Exact Mass262.94
IUPAC Name6-(difluoromethyl)-2,4-difluoropyridine-3-sulfonyl chloride
SMILESO=S(=O)(Cl)c1c(F)cc(C(F)F)nc1F
InChIInChI=1S/C6H2ClF4NO2S/c7-15(13,14)4-2(8)1-3(5(9)10)12-6(4)11/h1,5H
InChIKeyIGUXEQRPPIQKFD-UHFFFAOYSA-N
XLogP2.22
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.60
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

3-chloro-6-(difluoromethyl)-4-fluoropyridine-2-sulfonamide
CID 134663670
4-amino-2-bromo-6-(difluoromethyl)pyridine-3-sulfonyl chloride
CID 118840544
3-amino-6-(difluoromethyl)-2-fluoropyridine-4-sulfonamide
CID 130104467
2-cyano-6-(difluoromethyl)-4-fluoropyridine-3-sulfonamide
CID 134684129
4-chloro-6-(difluoromethyl)pyridine-2-sulfonyl chloride
CID 118834021
2-chloro-6-(difluoromethyl)pyridine-4-sulfonyl chloride
CID 130095745
4-chloro-2,6-difluorobenzenesulfonyl chloride
CID 50998405
4-chloro-6-(difluoromethyl)-2,3-difluoropyridine
CID 118811179
4-chloro-6-(difluoromethyl)-3-hydroxypyridine-2-sulfonyl chloride
CID 130072883
4-bromo-2-(difluoromethyl)-6-fluoropyridine-3-sulfonyl chloride
CID 118799821
3-chloro-6-(difluoromethyl)-2-methylpyridine-4-sulfonyl chloride
CID 130074580
3-(difluoromethyl)-5-fluoropyridine-4-sulfonyl chloride
CID 130096577

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-2,4-difluoropyridine-3-sulfonyl chloride?
The IUPAC name of 6-(difluoromethyl)-2,4-difluoropyridine-3-sulfonyl chloride (CID 130099937) is 6-(difluoromethyl)-2,4-difluoropyridine-3-sulfonyl chloride.
What is the SMILES notation for 6-(difluoromethyl)-2,4-difluoropyridine-3-sulfonyl chloride?
The canonical SMILES for 6-(difluoromethyl)-2,4-difluoropyridine-3-sulfonyl chloride is O=S(=O)(Cl)c1c(F)cc(C(F)F)nc1F.
What is the InChIKey of 6-(difluoromethyl)-2,4-difluoropyridine-3-sulfonyl chloride?
The InChIKey is IGUXEQRPPIQKFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2ClF4NO2S/c7-15(13,14)4-2(8)1-3(5(9)10)12-6(4)11/h1,5H.
What are the key properties of 6-(difluoromethyl)-2,4-difluoropyridine-3-sulfonyl chloride?
6-(difluoromethyl)-2,4-difluoropyridine-3-sulfonyl chloride has a molecular weight of 263.60 g/mol, XLogP of 2.22, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-2,4-difluoropyridine-3-sulfonyl chloride is sourced from PubChem (CID 130099937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).