2,3-dichloro-5-(2,4,6-trichlorophenyl)pyridine

C11H4Cl5N — CID 118815218

IUPAC2,3-dichloro-5-(2,4,6-trichlorophenyl)pyridine
SMILESClc1cc(Cl)c(-c2cnc(Cl)c(Cl)c2)c(Cl)c1
InChIInChI=1S/C11H4Cl5N/c12-6-2-7(13)10(8(14)3-6)5-1-9(15)11(16)17-4-5/h1-4H
InChIKeyBGGLYAPTXVQGRQ-UHFFFAOYSA-N
MW327.43 g/mol
LogP6.02
Rot. Bonds1

About 2,3-dichloro-5-(2,4,6-trichlorophenyl)pyridine

2,3-dichloro-5-(2,4,6-trichlorophenyl)pyridine (PubChem CID 118815218) has the molecular formula C11H4Cl5N and a molecular weight of 327.43 g/mol. Its IUPAC name is 2,3-dichloro-5-(2,4,6-trichlorophenyl)pyridine.

Molecular Properties

Compound Name2,3-dichloro-5-(2,4,6-trichlorophenyl)pyridine
PubChem CID118815218
Molecular FormulaC11H4Cl5N
Molecular Weight327.43 g/mol
Exact Mass324.88
IUPAC Name2,3-dichloro-5-(2,4,6-trichlorophenyl)pyridine
SMILESClc1cc(Cl)c(-c2cnc(Cl)c(Cl)c2)c(Cl)c1
InChIInChI=1S/C11H4Cl5N/c12-6-2-7(13)10(8(14)3-6)5-1-9(15)11(16)17-4-5/h1-4H
InChIKeyBGGLYAPTXVQGRQ-UHFFFAOYSA-N
XLogP6.02
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.43
LogP ≤ 56.02
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

2,3-dichloro-5-(2,6-dichlorophenyl)pyridine
CID 118826487
CID 162106307
CID 162106307
2,5-bis(2,4,6-trichlorophenyl)pyridine-3-carbaldehyde
CID 134637848
3-hydroxy-5-(2,4,6-trichlorophenyl)pyridine-2-carboxylic acid
CID 133092347
2-amino-5-(2,4,6-trichlorophenyl)pyridine-3-carbaldehyde
CID 119014537
2-chloro-5-(2,3,5-trichlorophenyl)pyridin-3-amine
CID 134636944
2-[2,5-bis(2,4,6-trichlorophenyl)-3-pyridinyl]acetonitrile
CID 134635727
5,6-dichloropyridine-3-carbaldehyde
CID 11535654
2-[2-amino-5-(2,4,6-trichlorophenyl)-3-pyridinyl]acetonitrile
CID 134618494
3-(5,6-dichloro-3-pyridinyl)prop-2-en-1-amine
CID 169463327
methyl 3,5-bis(2,4,6-trichlorophenyl)pyridine-2-carboxylate
CID 134636546
5-(2,4,6-trichlorophenyl)pyridine-3-carbonitrile
CID 134636778

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-5-(2,4,6-trichlorophenyl)pyridine?
The IUPAC name of 2,3-dichloro-5-(2,4,6-trichlorophenyl)pyridine (CID 118815218) is 2,3-dichloro-5-(2,4,6-trichlorophenyl)pyridine.
What is the SMILES notation for 2,3-dichloro-5-(2,4,6-trichlorophenyl)pyridine?
The canonical SMILES for 2,3-dichloro-5-(2,4,6-trichlorophenyl)pyridine is Clc1cc(Cl)c(-c2cnc(Cl)c(Cl)c2)c(Cl)c1.
What is the InChIKey of 2,3-dichloro-5-(2,4,6-trichlorophenyl)pyridine?
The InChIKey is BGGLYAPTXVQGRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H4Cl5N/c12-6-2-7(13)10(8(14)3-6)5-1-9(15)11(16)17-4-5/h1-4H.
What are the key properties of 2,3-dichloro-5-(2,4,6-trichlorophenyl)pyridine?
2,3-dichloro-5-(2,4,6-trichlorophenyl)pyridine has a molecular weight of 327.43 g/mol, XLogP of 6.02, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-5-(2,4,6-trichlorophenyl)pyridine is sourced from PubChem (CID 118815218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).