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

C7H3ClF5NO2S — CID 118832269

IUPAC2-(difluoromethyl)-5-(trifluoromethyl)pyridine-3-sulfonyl chloride
SMILESO=S(=O)(Cl)c1cc(C(F)(F)F)cnc1C(F)F
InChIInChI=1S/C7H3ClF5NO2S/c8-17(15,16)4-1-3(7(11,12)13)2-14-5(4)6(9)10/h1-2,6H
InChIKeyVMGMLPOKSSOZPE-UHFFFAOYSA-N
MW295.62 g/mol
LogP2.97
Rot. Bonds2

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

2-(difluoromethyl)-5-(trifluoromethyl)pyridine-3-sulfonyl chloride (PubChem CID 118832269) has the molecular formula C7H3ClF5NO2S and a molecular weight of 295.62 g/mol. Its IUPAC name is 2-(difluoromethyl)-5-(trifluoromethyl)pyridine-3-sulfonyl chloride.

Molecular Properties

Compound Name2-(difluoromethyl)-5-(trifluoromethyl)pyridine-3-sulfonyl chloride
PubChem CID118832269
Molecular FormulaC7H3ClF5NO2S
Molecular Weight295.62 g/mol
Exact Mass294.95
IUPAC Name2-(difluoromethyl)-5-(trifluoromethyl)pyridine-3-sulfonyl chloride
SMILESO=S(=O)(Cl)c1cc(C(F)(F)F)cnc1C(F)F
InChIInChI=1S/C7H3ClF5NO2S/c8-17(15,16)4-1-3(7(11,12)13)2-14-5(4)6(9)10/h1-2,6H
InChIKeyVMGMLPOKSSOZPE-UHFFFAOYSA-N
XLogP2.97
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.62
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-5-(trifluoromethyl)pyridine-3-sulfonyl chloride
CID 57361942
5-chloro-2-(difluoromethyl)pyridine-3-sulfonyl chloride
CID 130095757
5-(aminomethyl)-2-(difluoromethyl)pyridine-3-sulfonyl chloride
CID 134664079
2-(difluoromethyl)-3-(trifluoromethyl)pyridine-4-sulfonyl chloride
CID 118832290
1-[[3-chlorosulfonyl-5-(trifluoromethyl)-2-pyridinyl]oxy]propan-2-yl acetate
CID 126662223
5-(aminomethyl)-2-(difluoromethyl)-4-(trifluoromethyl)pyridine-3-sulfonyl chloride
CID 133084836
2-chloro-N-methyl-5-(trifluoromethyl)pyridine-3-sulfonamide
CID 162420965
2,3-difluoro-5-(trifluoromethyl)benzenesulfonyl chloride
CID 151611136
2-iodo-5-(trifluoromethyl)pyridine-3-sulfonamide
CID 131297996
6-(difluoromethyl)-5-hydroxy-4-methoxypyridine-3-sulfonyl chloride
CID 118849103
6-chloro-2-(difluoromethyl)-5-methoxypyridine-3-sulfonyl chloride
CID 130073999
5-cyano-6-(difluoromethyl)-4-fluoropyridine-3-sulfonyl chloride
CID 130076358

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-5-(trifluoromethyl)pyridine-3-sulfonyl chloride?
The IUPAC name of 2-(difluoromethyl)-5-(trifluoromethyl)pyridine-3-sulfonyl chloride (CID 118832269) is 2-(difluoromethyl)-5-(trifluoromethyl)pyridine-3-sulfonyl chloride.
What is the SMILES notation for 2-(difluoromethyl)-5-(trifluoromethyl)pyridine-3-sulfonyl chloride?
The canonical SMILES for 2-(difluoromethyl)-5-(trifluoromethyl)pyridine-3-sulfonyl chloride is O=S(=O)(Cl)c1cc(C(F)(F)F)cnc1C(F)F.
What is the InChIKey of 2-(difluoromethyl)-5-(trifluoromethyl)pyridine-3-sulfonyl chloride?
The InChIKey is VMGMLPOKSSOZPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3ClF5NO2S/c8-17(15,16)4-1-3(7(11,12)13)2-14-5(4)6(9)10/h1-2,6H.
What are the key properties of 2-(difluoromethyl)-5-(trifluoromethyl)pyridine-3-sulfonyl chloride?
2-(difluoromethyl)-5-(trifluoromethyl)pyridine-3-sulfonyl chloride has a molecular weight of 295.62 g/mol, XLogP of 2.97, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-5-(trifluoromethyl)pyridine-3-sulfonyl chloride is sourced from PubChem (CID 118832269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).