2,3,5,6-tetrachloro-4-(trifluoromethyl)pyridine

C6Cl4F3N — CID 14269942

IUPAC2,3,5,6-tetrachloro-4-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1c(Cl)c(Cl)nc(Cl)c1Cl
InChIInChI=1S/C6Cl4F3N/c7-2-1(6(11,12)13)3(8)5(10)14-4(2)9
InChIKeyODMXIQKLIHQOTC-UHFFFAOYSA-N
MW284.88 g/mol
LogP4.71
Rot. Bonds

About 2,3,5,6-tetrachloro-4-(trifluoromethyl)pyridine

2,3,5,6-tetrachloro-4-(trifluoromethyl)pyridine (PubChem CID 14269942) has the molecular formula C6Cl4F3N and a molecular weight of 284.88 g/mol. Its IUPAC name is 2,3,5,6-tetrachloro-4-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2,3,5,6-tetrachloro-4-(trifluoromethyl)pyridine
PubChem CID14269942
Molecular FormulaC6Cl4F3N
Molecular Weight284.88 g/mol
Exact Mass282.87
IUPAC Name2,3,5,6-tetrachloro-4-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1c(Cl)c(Cl)nc(Cl)c1Cl
InChIInChI=1S/C6Cl4F3N/c7-2-1(6(11,12)13)3(8)5(10)14-4(2)9
InChIKeyODMXIQKLIHQOTC-UHFFFAOYSA-N
XLogP4.71
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.88
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,3,5,6-tetrachloro-4-(trifluoromethyl)pyridine?
The IUPAC name of 2,3,5,6-tetrachloro-4-(trifluoromethyl)pyridine (CID 14269942) is 2,3,5,6-tetrachloro-4-(trifluoromethyl)pyridine.
What is the SMILES notation for 2,3,5,6-tetrachloro-4-(trifluoromethyl)pyridine?
The canonical SMILES for 2,3,5,6-tetrachloro-4-(trifluoromethyl)pyridine is FC(F)(F)c1c(Cl)c(Cl)nc(Cl)c1Cl.
What is the InChIKey of 2,3,5,6-tetrachloro-4-(trifluoromethyl)pyridine?
The InChIKey is ODMXIQKLIHQOTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6Cl4F3N/c7-2-1(6(11,12)13)3(8)5(10)14-4(2)9.
What are the key properties of 2,3,5,6-tetrachloro-4-(trifluoromethyl)pyridine?
2,3,5,6-tetrachloro-4-(trifluoromethyl)pyridine has a molecular weight of 284.88 g/mol, XLogP of 4.71, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,6-tetrachloro-4-(trifluoromethyl)pyridine is sourced from PubChem (CID 14269942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).