2,3,4,5-tetrachloro-6-fluoropyridine

C5Cl4FN — CID 616636

IUPAC2,3,4,5-tetrachloro-6-fluoropyridine
SMILESFc1nc(Cl)c(Cl)c(Cl)c1Cl
InChIInChI=1S/C5Cl4FN/c6-1-2(7)4(9)11-5(10)3(1)8
InChIKeyIKZSQJOVXGDGAH-UHFFFAOYSA-N
MW234.87 g/mol
LogP3.83
Rot. Bonds

About 2,3,4,5-tetrachloro-6-fluoropyridine

2,3,4,5-tetrachloro-6-fluoropyridine (PubChem CID 616636) has the molecular formula C5Cl4FN and a molecular weight of 234.87 g/mol. Its IUPAC name is 2,3,4,5-tetrachloro-6-fluoropyridine.

Molecular Properties

Compound Name2,3,4,5-tetrachloro-6-fluoropyridine
PubChem CID616636
Molecular FormulaC5Cl4FN
Molecular Weight234.87 g/mol
Exact Mass232.88
IUPAC Name2,3,4,5-tetrachloro-6-fluoropyridine
SMILESFc1nc(Cl)c(Cl)c(Cl)c1Cl
InChIInChI=1S/C5Cl4FN/c6-1-2(7)4(9)11-5(10)3(1)8
InChIKeyIKZSQJOVXGDGAH-UHFFFAOYSA-N
XLogP3.83
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.87
LogP ≤ 53.83
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 2,3,4,5-tetrachloro-6-fluoropyridine?
The IUPAC name of 2,3,4,5-tetrachloro-6-fluoropyridine (CID 616636) is 2,3,4,5-tetrachloro-6-fluoropyridine.
What is the SMILES notation for 2,3,4,5-tetrachloro-6-fluoropyridine?
The canonical SMILES for 2,3,4,5-tetrachloro-6-fluoropyridine is Fc1nc(Cl)c(Cl)c(Cl)c1Cl.
What is the InChIKey of 2,3,4,5-tetrachloro-6-fluoropyridine?
The InChIKey is IKZSQJOVXGDGAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5Cl4FN/c6-1-2(7)4(9)11-5(10)3(1)8.
What are the key properties of 2,3,4,5-tetrachloro-6-fluoropyridine?
2,3,4,5-tetrachloro-6-fluoropyridine has a molecular weight of 234.87 g/mol, XLogP of 3.83, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5-tetrachloro-6-fluoropyridine is sourced from PubChem (CID 616636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).