2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine

C6H2BrClF3N — CID 118997697

IUPAC2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine
SMILESFc1cc(Cl)c(C(F)F)nc1Br
InChIInChI=1S/C6H2BrClF3N/c7-5-3(9)1-2(8)4(12-5)6(10)11/h1,6H
InChIKeyWLHQHKKWCLQPFG-UHFFFAOYSA-N
MW260.44 g/mol
LogP3.57
Rot. Bonds1

About 2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine

2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine (PubChem CID 118997697) has the molecular formula C6H2BrClF3N and a molecular weight of 260.44 g/mol. Its IUPAC name is 2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine.

Molecular Properties

Compound Name2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine
PubChem CID118997697
Molecular FormulaC6H2BrClF3N
Molecular Weight260.44 g/mol
Exact Mass258.90
IUPAC Name2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine
SMILESFc1cc(Cl)c(C(F)F)nc1Br
InChIInChI=1S/C6H2BrClF3N/c7-5-3(9)1-2(8)4(12-5)6(10)11/h1,6H
InChIKeyWLHQHKKWCLQPFG-UHFFFAOYSA-N
XLogP3.57
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.44
LogP ≤ 53.57
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-(bromomethyl)-5-chloro-6-(difluoromethyl)-3-fluoropyridine
CID 130071737
2-bromo-3-(chloromethyl)-6-(difluoromethyl)-5-fluoropyridine
CID 119011286
3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine
CID 119012391
3-chloro-2-(difluoromethyl)-5-fluoro-6-nitropyridine
CID 130071661
2-bromo-3-chloro-5-(chloromethyl)-6-(difluoromethyl)pyridine
CID 118995980
5-chloro-2-(difluoromethyl)-3-fluoro-6-methylpyridine
CID 130071645
5-chloro-6-(difluoromethyl)-2-fluoropyridin-3-amine
CID 130102453
2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine
CID 118834001
2-bromo-6-(difluoromethyl)-5-fluoropyridine-3-carbonyl chloride
CID 130109869
5-chloro-2-(difluoromethyl)-3-fluoro-6-(trifluoromethyl)pyridine
CID 134685820
3-chloro-2-(chloromethyl)-6-(difluoromethyl)-5-fluoropyridine
CID 130071793
2-bromo-6-(difluoromethyl)-5-fluoro-3-methoxypyridine
CID 119009048

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine?
The IUPAC name of 2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine (CID 118997697) is 2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine.
What is the SMILES notation for 2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine?
The canonical SMILES for 2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine is Fc1cc(Cl)c(C(F)F)nc1Br.
What is the InChIKey of 2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine?
The InChIKey is WLHQHKKWCLQPFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2BrClF3N/c7-5-3(9)1-2(8)4(12-5)6(10)11/h1,6H.
What are the key properties of 2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine?
2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine has a molecular weight of 260.44 g/mol, XLogP of 3.57, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine is sourced from PubChem (CID 118997697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).