2,4,6-trichloropyridine

C5H2Cl3N — CID 27665

IUPAC2,4,6-trichloropyridine
SMILESClc1cc(Cl)nc(Cl)c1
InChIInChI=1S/C5H2Cl3N/c6-3-1-4(7)9-5(8)2-3/h1-2H
InChIKeyFJNNGKMAGDPVIU-UHFFFAOYSA-N
MW182.44 g/mol
LogP3.04
Rot. Bonds

About 2,4,6-trichloropyridine

2,4,6-trichloropyridine (PubChem CID 27665) has the molecular formula C5H2Cl3N and a molecular weight of 182.44 g/mol. Its IUPAC name is 2,4,6-trichloropyridine.

Molecular Properties

Compound Name2,4,6-trichloropyridine
PubChem CID27665
Molecular FormulaC5H2Cl3N
Molecular Weight182.44 g/mol
Exact Mass180.93
IUPAC Name2,4,6-trichloropyridine
SMILESClc1cc(Cl)nc(Cl)c1
InChIInChI=1S/C5H2Cl3N/c6-3-1-4(7)9-5(8)2-3/h1-2H
InChIKeyFJNNGKMAGDPVIU-UHFFFAOYSA-N
XLogP3.04
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.44
LogP ≤ 53.04
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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Related Compounds

Nitrapyrin
CID 16004
2-Chloropyridine
CID 7977
2,3,5,6-Tetrachloropyridine
CID 16990
3-Chloropyridine
CID 12287
2,6-Dichloropyridine
CID 16989
2,3-Dichloropyridine
CID 16988
4-Chloropyridine
CID 12288
4-Chloropyridine hydrochloride
CID 81852
3,5-Dichloropyridine
CID 17153
2,6-Dichloro-3-pyridylamine
CID 112846
2,5-Dichloropyridine
CID 27685
6-Chloro-2-picoline
CID 87601

Frequently Asked Questions

What is the IUPAC name of 2,4,6-trichloropyridine?
The IUPAC name of 2,4,6-trichloropyridine (CID 27665) is 2,4,6-trichloropyridine.
What is the SMILES notation for 2,4,6-trichloropyridine?
The canonical SMILES for 2,4,6-trichloropyridine is Clc1cc(Cl)nc(Cl)c1.
What is the InChIKey of 2,4,6-trichloropyridine?
The InChIKey is FJNNGKMAGDPVIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H2Cl3N/c6-3-1-4(7)9-5(8)2-3/h1-2H.
What are the key properties of 2,4,6-trichloropyridine?
2,4,6-trichloropyridine has a molecular weight of 182.44 g/mol, XLogP of 3.04, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-trichloropyridine is sourced from PubChem (CID 27665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).