2,6-dichloro-3-(difluoromethoxy)pyridine

C6H3Cl2F2NO — CID 46311561

IUPAC2,6-dichloro-3-(difluoromethoxy)pyridine
SMILESFC(F)Oc1ccc(Cl)nc1Cl
InChIInChI=1S/C6H3Cl2F2NO/c7-4-2-1-3(5(8)11-4)12-6(9)10/h1-2,6H
InChIKeyITKPJHDSBLIIIZ-UHFFFAOYSA-N
MW214.00 g/mol
LogP2.99
Rot. Bonds2

About 2,6-dichloro-3-(difluoromethoxy)pyridine

2,6-dichloro-3-(difluoromethoxy)pyridine (PubChem CID 46311561) has the molecular formula C6H3Cl2F2NO and a molecular weight of 214.00 g/mol. Its IUPAC name is 2,6-dichloro-3-(difluoromethoxy)pyridine.

Molecular Properties

Compound Name2,6-dichloro-3-(difluoromethoxy)pyridine
PubChem CID46311561
Molecular FormulaC6H3Cl2F2NO
Molecular Weight214.00 g/mol
Exact Mass212.96
IUPAC Name2,6-dichloro-3-(difluoromethoxy)pyridine
SMILESFC(F)Oc1ccc(Cl)nc1Cl
InChIInChI=1S/C6H3Cl2F2NO/c7-4-2-1-3(5(8)11-4)12-6(9)10/h1-2,6H
InChIKeyITKPJHDSBLIIIZ-UHFFFAOYSA-N
XLogP2.99
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.00
LogP ≤ 52.99
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 2,6-dichloro-3-(difluoromethoxy)pyridine?
The IUPAC name of 2,6-dichloro-3-(difluoromethoxy)pyridine (CID 46311561) is 2,6-dichloro-3-(difluoromethoxy)pyridine.
What is the SMILES notation for 2,6-dichloro-3-(difluoromethoxy)pyridine?
The canonical SMILES for 2,6-dichloro-3-(difluoromethoxy)pyridine is FC(F)Oc1ccc(Cl)nc1Cl.
What is the InChIKey of 2,6-dichloro-3-(difluoromethoxy)pyridine?
The InChIKey is ITKPJHDSBLIIIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3Cl2F2NO/c7-4-2-1-3(5(8)11-4)12-6(9)10/h1-2,6H.
What are the key properties of 2,6-dichloro-3-(difluoromethoxy)pyridine?
2,6-dichloro-3-(difluoromethoxy)pyridine has a molecular weight of 214.00 g/mol, XLogP of 2.99, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-3-(difluoromethoxy)pyridine is sourced from PubChem (CID 46311561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).