2-chloro-3,4,5,6-tetrafluoropyridine

C5ClF4N — CID 603974

IUPAC2-chloro-3,4,5,6-tetrafluoropyridine
SMILESFc1nc(Cl)c(F)c(F)c1F
InChIInChI=1S/C5ClF4N/c6-4-2(8)1(7)3(9)5(10)11-4
InChIKeyPZKCMMYXVQQOKQ-UHFFFAOYSA-N
MW185.51 g/mol
LogP2.29
Rot. Bonds

About 2-chloro-3,4,5,6-tetrafluoropyridine

2-chloro-3,4,5,6-tetrafluoropyridine (PubChem CID 603974) has the molecular formula C5ClF4N and a molecular weight of 185.51 g/mol. Its IUPAC name is 2-chloro-3,4,5,6-tetrafluoropyridine.

Molecular Properties

Compound Name2-chloro-3,4,5,6-tetrafluoropyridine
PubChem CID603974
Molecular FormulaC5ClF4N
Molecular Weight185.51 g/mol
Exact Mass184.97
IUPAC Name2-chloro-3,4,5,6-tetrafluoropyridine
SMILESFc1nc(Cl)c(F)c(F)c1F
InChIInChI=1S/C5ClF4N/c6-4-2(8)1(7)3(9)5(10)11-4
InChIKeyPZKCMMYXVQQOKQ-UHFFFAOYSA-N
XLogP2.29
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.51
LogP ≤ 52.29
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-chloro-3,4,5,6-tetrafluoropyridine?
The IUPAC name of 2-chloro-3,4,5,6-tetrafluoropyridine (CID 603974) is 2-chloro-3,4,5,6-tetrafluoropyridine.
What is the SMILES notation for 2-chloro-3,4,5,6-tetrafluoropyridine?
The canonical SMILES for 2-chloro-3,4,5,6-tetrafluoropyridine is Fc1nc(Cl)c(F)c(F)c1F.
What is the InChIKey of 2-chloro-3,4,5,6-tetrafluoropyridine?
The InChIKey is PZKCMMYXVQQOKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5ClF4N/c6-4-2(8)1(7)3(9)5(10)11-4.
What are the key properties of 2-chloro-3,4,5,6-tetrafluoropyridine?
2-chloro-3,4,5,6-tetrafluoropyridine has a molecular weight of 185.51 g/mol, XLogP of 2.29, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-3,4,5,6-tetrafluoropyridine is sourced from PubChem (CID 603974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).