2-chloro-6-(difluoromethyl)pyridine-4-sulfonyl chloride

C6H3Cl2F2NO2S — CID 130095745

IUPAC2-chloro-6-(difluoromethyl)pyridine-4-sulfonyl chloride
SMILESO=S(=O)(Cl)c1cc(Cl)nc(C(F)F)c1
InChIInChI=1S/C6H3Cl2F2NO2S/c7-5-2-3(14(8,12)13)1-4(11-5)6(9)10/h1-2,6H
InChIKeyGHDGCQIGTNXYLA-UHFFFAOYSA-N
MW262.06 g/mol
LogP2.60
Rot. Bonds2

About 2-chloro-6-(difluoromethyl)pyridine-4-sulfonyl chloride

2-chloro-6-(difluoromethyl)pyridine-4-sulfonyl chloride (PubChem CID 130095745) has the molecular formula C6H3Cl2F2NO2S and a molecular weight of 262.06 g/mol. Its IUPAC name is 2-chloro-6-(difluoromethyl)pyridine-4-sulfonyl chloride.

Molecular Properties

Compound Name2-chloro-6-(difluoromethyl)pyridine-4-sulfonyl chloride
PubChem CID130095745
Molecular FormulaC6H3Cl2F2NO2S
Molecular Weight262.06 g/mol
Exact Mass260.92
IUPAC Name2-chloro-6-(difluoromethyl)pyridine-4-sulfonyl chloride
SMILESO=S(=O)(Cl)c1cc(Cl)nc(C(F)F)c1
InChIInChI=1S/C6H3Cl2F2NO2S/c7-5-2-3(14(8,12)13)1-4(11-5)6(9)10/h1-2,6H
InChIKeyGHDGCQIGTNXYLA-UHFFFAOYSA-N
XLogP2.60
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.06
LogP ≤ 52.60
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

4-chloro-6-(difluoromethyl)pyridine-2-sulfonyl chloride
CID 118834021
4-chloro-6-(difluoromethyl)-3-hydroxypyridine-2-sulfonyl chloride
CID 130072883
3-chloro-6-(difluoromethyl)-2-methylpyridine-4-sulfonyl chloride
CID 130074580
4-amino-2-bromo-6-(difluoromethyl)pyridine-3-sulfonyl chloride
CID 118840544
6-(difluoromethyl)-2,4-difluoropyridine-3-sulfonyl chloride
CID 130099937
2-chloro-6-(difluoromethyl)-4-(trifluoromethyl)pyridine
CID 119003399
6-chloro-2-(difluoromethyl)-3-iodopyridine-4-sulfonyl chloride
CID 130073549
3-chloro-6-(difluoromethyl)-4-nitropyridine-2-sulfonyl chloride
CID 131446537
6-(difluoromethyl)-4-iodo-3-methylpyridine-2-sulfonyl chloride
CID 130086391
4-amino-3-bromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride
CID 118817000
5-chloro-2-(difluoromethyl)pyridine-4-sulfonyl chloride
CID 130095758
3-chloro-6-(difluoromethyl)-4-fluoropyridine-2-sulfonamide
CID 134663670

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(difluoromethyl)pyridine-4-sulfonyl chloride?
The IUPAC name of 2-chloro-6-(difluoromethyl)pyridine-4-sulfonyl chloride (CID 130095745) is 2-chloro-6-(difluoromethyl)pyridine-4-sulfonyl chloride.
What is the SMILES notation for 2-chloro-6-(difluoromethyl)pyridine-4-sulfonyl chloride?
The canonical SMILES for 2-chloro-6-(difluoromethyl)pyridine-4-sulfonyl chloride is O=S(=O)(Cl)c1cc(Cl)nc(C(F)F)c1.
What is the InChIKey of 2-chloro-6-(difluoromethyl)pyridine-4-sulfonyl chloride?
The InChIKey is GHDGCQIGTNXYLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3Cl2F2NO2S/c7-5-2-3(14(8,12)13)1-4(11-5)6(9)10/h1-2,6H.
What are the key properties of 2-chloro-6-(difluoromethyl)pyridine-4-sulfonyl chloride?
2-chloro-6-(difluoromethyl)pyridine-4-sulfonyl chloride has a molecular weight of 262.06 g/mol, XLogP of 2.60, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(difluoromethyl)pyridine-4-sulfonyl chloride is sourced from PubChem (CID 130095745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).