4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonyl chloride

C7H5Cl2F2NO2S — CID 130074571

IUPAC4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonyl chloride
SMILESCc1ncc(S(=O)(=O)Cl)c(Cl)c1C(F)F
InChIInChI=1S/C7H5Cl2F2NO2S/c1-3-5(7(10)11)6(8)4(2-12-3)15(9,13)14/h2,7H,1H3
InChIKeyHEWMJNWOOAPMPP-UHFFFAOYSA-N
MW276.09 g/mol
LogP2.91
Rot. Bonds2

About 4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonyl chloride

4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonyl chloride (PubChem CID 130074571) has the molecular formula C7H5Cl2F2NO2S and a molecular weight of 276.09 g/mol. Its IUPAC name is 4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonyl chloride.

Molecular Properties

Compound Name4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonyl chloride
PubChem CID130074571
Molecular FormulaC7H5Cl2F2NO2S
Molecular Weight276.09 g/mol
Exact Mass274.94
IUPAC Name4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonyl chloride
SMILESCc1ncc(S(=O)(=O)Cl)c(Cl)c1C(F)F
InChIInChI=1S/C7H5Cl2F2NO2S/c1-3-5(7(10)11)6(8)4(2-12-3)15(9,13)14/h2,7H,1H3
InChIKeyHEWMJNWOOAPMPP-UHFFFAOYSA-N
XLogP2.91
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.09
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonamide
CID 130074592
4-bromo-5-(difluoromethyl)-6-methylpyridine-3-sulfonyl chloride
CID 118817278
4-chloro-6-cyano-5-(difluoromethyl)pyridine-3-sulfonyl chloride
CID 118799899
4-chloro-5-(difluoromethyl)-6-nitropyridine-3-sulfonyl chloride
CID 131446510
5-chloro-4-(difluoromethyl)-6-nitropyridine-3-sulfonyl chloride
CID 131446496
4-(difluoromethyl)-5-fluoro-2-methylpyridine-3-sulfonyl chloride
CID 118823664
5-(difluoromethyl)-4,6-difluoropyridine-3-sulfonyl chloride
CID 130099934
4-chloro-5-(difluoromethyl)-6-methylpyridine-3-carbonitrile
CID 118850677
5-(difluoromethyl)-4-methoxy-6-methylpyridine-3-sulfonamide
CID 133098987
6-bromo-5-(difluoromethyl)-4-fluoropyridine-3-sulfonyl chloride
CID 130109897
6-amino-4-chloro-5-(difluoromethyl)pyridine-3-sulfonamide
CID 119016728
3-chloro-6-(difluoromethyl)-2-methylpyridine-4-sulfonyl chloride
CID 130074580

Frequently Asked Questions

What is the IUPAC name of 4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonyl chloride?
The IUPAC name of 4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonyl chloride (CID 130074571) is 4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonyl chloride.
What is the SMILES notation for 4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonyl chloride?
The canonical SMILES for 4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonyl chloride is Cc1ncc(S(=O)(=O)Cl)c(Cl)c1C(F)F.
What is the InChIKey of 4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonyl chloride?
The InChIKey is HEWMJNWOOAPMPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5Cl2F2NO2S/c1-3-5(7(10)11)6(8)4(2-12-3)15(9,13)14/h2,7H,1H3.
What are the key properties of 4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonyl chloride?
4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonyl chloride has a molecular weight of 276.09 g/mol, XLogP of 2.91, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonyl chloride is sourced from PubChem (CID 130074571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).