3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine

C₁₂H₄Cl₄F₃N — CID 134636127

About 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine

3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine (PubChem CID 134636127) has the molecular formula C₁₂H₄Cl₄F₃N and a molecular weight of 360.98 g/mol. Its IUPAC name is 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine.

Molecular Properties

• Compound Name: 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine
• PubChem CID: 134636127
• Molecular Formula: C₁₂H₄Cl₄F₃N
• Molecular Weight: 360.98 g/mol
• Exact Mass: 358.90
• IUPAC Name: 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine
• SMILES: FC(F)(F)c1ccnc(-c2c(Cl)cc(Cl)cc2Cl)c1Cl
• InChI: InChI=1S/C12H4Cl4F3N/c13-5-3-7(14)9(8(15)4-5)11-10(16)6(1-2-20-11)12(17,18)19/h1-4H
• InChIKey: SUIHMGSLTMKHBD-UHFFFAOYSA-N
• XLogP: 6.38
• TPSA: 12.89 Ų
• H-Bond Acceptors: 1
• Rotatable Bonds: 1
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	360.98
LogP ≤ 5	6.38
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine?

The IUPAC name of 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine (CID 134636127) is 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine.

What is the SMILES notation for 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine?

The canonical SMILES for 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine is FC(F)(F)c1ccnc(-c2c(Cl)cc(Cl)cc2Cl)c1Cl.

What is the InChIKey of 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine?

The InChIKey is SUIHMGSLTMKHBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H4Cl4F3N/c13-5-3-7(14)9(8(15)4-5)11-10(16)6(1-2-20-11)12(17,18)19/h1-4H.

What are the key properties of 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine?

3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine has a molecular weight of 360.98 g/mol, XLogP of 6.38, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for 3-chloro-2-(2,4,6-trichlorophenyl)-4-(trifluoromethyl)pyridine is sourced from PubChem (CID 134636127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 134636127 — identifiers, structure, computed properties (public domain)

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