5-chloro-2-(difluoromethyl)pyridine-3-sulfonyl chloride

C6H3Cl2F2NO2S — CID 130095757

IUPAC5-chloro-2-(difluoromethyl)pyridine-3-sulfonyl chloride
SMILESO=S(=O)(Cl)c1cc(Cl)cnc1C(F)F
InChIInChI=1S/C6H3Cl2F2NO2S/c7-3-1-4(14(8,12)13)5(6(9)10)11-2-3/h1-2,6H
InChIKeyZBQGRUUJEDFWBZ-UHFFFAOYSA-N
MW262.06 g/mol
LogP2.60
Rot. Bonds2

About 5-chloro-2-(difluoromethyl)pyridine-3-sulfonyl chloride

5-chloro-2-(difluoromethyl)pyridine-3-sulfonyl chloride (PubChem CID 130095757) has the molecular formula C6H3Cl2F2NO2S and a molecular weight of 262.06 g/mol. Its IUPAC name is 5-chloro-2-(difluoromethyl)pyridine-3-sulfonyl chloride.

Molecular Properties

Compound Name5-chloro-2-(difluoromethyl)pyridine-3-sulfonyl chloride
PubChem CID130095757
Molecular FormulaC6H3Cl2F2NO2S
Molecular Weight262.06 g/mol
Exact Mass260.92
IUPAC Name5-chloro-2-(difluoromethyl)pyridine-3-sulfonyl chloride
SMILESO=S(=O)(Cl)c1cc(Cl)cnc1C(F)F
InChIInChI=1S/C6H3Cl2F2NO2S/c7-3-1-4(14(8,12)13)5(6(9)10)11-2-3/h1-2,6H
InChIKeyZBQGRUUJEDFWBZ-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

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Related Compounds

2-(difluoromethyl)-5-(trifluoromethyl)pyridine-3-sulfonyl chloride
CID 118832269
5-(aminomethyl)-2-(difluoromethyl)pyridine-3-sulfonyl chloride
CID 134664079
5-chloro-2-(difluoromethoxy)pyridine-3-sulfonyl chloride
CID 138675726
3,5-dichloro-2-(difluoromethyl)pyridine
CID 60622989
5-chloro-2-(difluoromethyl)pyridin-3-amine
CID 130094579
4-bromo-6-(difluoromethyl)-5-fluoropyridine-3-sulfonyl chloride
CID 118817690
5-chloro-2-(difluoromethyl)-3-(fluoromethyl)pyridine
CID 130095561
5-chloro-2-(difluoromethyl)pyridine-4-sulfonyl chloride
CID 130095758
5-cyano-6-(difluoromethyl)-4-fluoropyridine-3-sulfonyl chloride
CID 130076358
6-(difluoromethyl)-5-hydroxy-4-methoxypyridine-3-sulfonyl chloride
CID 118849103
6-chloro-2-(difluoromethyl)-5-methoxypyridine-3-sulfonyl chloride
CID 130073999
6-chloro-2-(difluoromethyl)-3-iodopyridine-4-sulfonyl chloride
CID 130073549

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(difluoromethyl)pyridine-3-sulfonyl chloride?
The IUPAC name of 5-chloro-2-(difluoromethyl)pyridine-3-sulfonyl chloride (CID 130095757) is 5-chloro-2-(difluoromethyl)pyridine-3-sulfonyl chloride.
What is the SMILES notation for 5-chloro-2-(difluoromethyl)pyridine-3-sulfonyl chloride?
The canonical SMILES for 5-chloro-2-(difluoromethyl)pyridine-3-sulfonyl chloride is O=S(=O)(Cl)c1cc(Cl)cnc1C(F)F.
What is the InChIKey of 5-chloro-2-(difluoromethyl)pyridine-3-sulfonyl chloride?
The InChIKey is ZBQGRUUJEDFWBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3Cl2F2NO2S/c7-3-1-4(14(8,12)13)5(6(9)10)11-2-3/h1-2,6H.
What are the key properties of 5-chloro-2-(difluoromethyl)pyridine-3-sulfonyl chloride?
5-chloro-2-(difluoromethyl)pyridine-3-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 5-chloro-2-(difluoromethyl)pyridine-3-sulfonyl chloride is sourced from PubChem (CID 130095757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).