2,3,4,5-tetrachloropyridine;2,3,5,6-tetrachloropyridine

C10H2Cl8N2 — CID 162092640

IUPAC2,3,4,5-tetrachloropyridine;2,3,5,6-tetrachloropyridine
SMILESClc1cc(Cl)c(Cl)nc1Cl.Clc1cnc(Cl)c(Cl)c1Cl
InChIInChI=1S/2C5HCl4N/c6-2-1-10-5(9)4(8)3(2)7;6-2-1-3(7)5(9)10-4(2)8/h2*1H
InChIKeyZDVAAPFAWSPNEQ-UHFFFAOYSA-N
MW433.76 g/mol
LogP7.39
Rot. Bonds

About 2,3,4,5-tetrachloropyridine;2,3,5,6-tetrachloropyridine

2,3,4,5-tetrachloropyridine;2,3,5,6-tetrachloropyridine (PubChem CID 162092640) has the molecular formula C10H2Cl8N2 and a molecular weight of 433.76 g/mol. Its IUPAC name is 2,3,4,5-tetrachloropyridine;2,3,5,6-tetrachloropyridine.

Molecular Properties

Compound Name2,3,4,5-tetrachloropyridine;2,3,5,6-tetrachloropyridine
PubChem CID162092640
Molecular FormulaC10H2Cl8N2
Molecular Weight433.76 g/mol
Exact Mass429.77
IUPAC Name2,3,4,5-tetrachloropyridine;2,3,5,6-tetrachloropyridine
SMILESClc1cc(Cl)c(Cl)nc1Cl.Clc1cnc(Cl)c(Cl)c1Cl
InChIInChI=1S/2C5HCl4N/c6-2-1-10-5(9)4(8)3(2)7;6-2-1-3(7)5(9)10-4(2)8/h2*1H
InChIKeyZDVAAPFAWSPNEQ-UHFFFAOYSA-N
XLogP7.39
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500433.76
LogP ≤ 57.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-tetrachloropyridine;2,3,5,6-tetrachloropyridine?
The IUPAC name of 2,3,4,5-tetrachloropyridine;2,3,5,6-tetrachloropyridine (CID 162092640) is 2,3,4,5-tetrachloropyridine;2,3,5,6-tetrachloropyridine.
What is the SMILES notation for 2,3,4,5-tetrachloropyridine;2,3,5,6-tetrachloropyridine?
The canonical SMILES for 2,3,4,5-tetrachloropyridine;2,3,5,6-tetrachloropyridine is Clc1cc(Cl)c(Cl)nc1Cl.Clc1cnc(Cl)c(Cl)c1Cl.
What is the InChIKey of 2,3,4,5-tetrachloropyridine;2,3,5,6-tetrachloropyridine?
The InChIKey is ZDVAAPFAWSPNEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5HCl4N/c6-2-1-10-5(9)4(8)3(2)7;6-2-1-3(7)5(9)10-4(2)8/h2*1H.
What are the key properties of 2,3,4,5-tetrachloropyridine;2,3,5,6-tetrachloropyridine?
2,3,4,5-tetrachloropyridine;2,3,5,6-tetrachloropyridine has a molecular weight of 433.76 g/mol, XLogP of 7.39, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5-tetrachloropyridine;2,3,5,6-tetrachloropyridine is sourced from PubChem (CID 162092640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).