2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine

C6H2Br2ClF2N — CID 118834001

IUPAC2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine
SMILESFC(F)c1c(Cl)cc(Br)nc1Br
InChIInChI=1S/C6H2Br2ClF2N/c7-3-1-2(9)4(6(10)11)5(8)12-3/h1,6H
InChIKeyBVAMXKOTSSNOKK-UHFFFAOYSA-N
MW321.35 g/mol
LogP4.20
Rot. Bonds1

About 2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine

2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine (PubChem CID 118834001) has the molecular formula C6H2Br2ClF2N and a molecular weight of 321.35 g/mol. Its IUPAC name is 2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine.

Molecular Properties

Compound Name2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine
PubChem CID118834001
Molecular FormulaC6H2Br2ClF2N
Molecular Weight321.35 g/mol
Exact Mass318.82
IUPAC Name2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine
SMILESFC(F)c1c(Cl)cc(Br)nc1Br
InChIInChI=1S/C6H2Br2ClF2N/c7-3-1-2(9)4(6(10)11)5(8)12-3/h1,6H
InChIKeyBVAMXKOTSSNOKK-UHFFFAOYSA-N
XLogP4.20
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.35
LogP ≤ 54.20
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

6-bromo-4-chloro-2-(difluoromethyl)pyridin-3-amine
CID 130101605
6-bromo-4-chloro-2-(difluoromethyl)-3-iodopyridine
CID 130107863
methyl 6-bromo-4-chloro-3-(difluoromethyl)pyridine-2-carboxylate
CID 130108301
2-bromo-5-chloro-6-(difluoromethyl)-3-fluoropyridine
CID 118997697
2-bromo-4-(chloromethyl)-3-(difluoromethyl)-6-methylpyridine
CID 130069219
6-bromo-3-chloro-2-(difluoromethyl)-4-iodopyridine
CID 130107866
2,4-dibromo-3-(difluoromethyl)-6-fluoropyridine
CID 118998950
6-bromo-4-(bromomethyl)-3-chloro-2-(difluoromethyl)pyridine
CID 130108046
2-bromo-3-chloro-5-(chloromethyl)-6-(difluoromethyl)pyridine
CID 118995980
2-bromo-4-(bromomethyl)-3-(difluoromethyl)-6-fluoropyridine
CID 119005806
2-bromo-3-(difluoromethyl)-4,6-diiodopyridine
CID 130100418
2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine
CID 119019803

Frequently Asked Questions

What is the IUPAC name of 2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine?
The IUPAC name of 2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine (CID 118834001) is 2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine.
What is the SMILES notation for 2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine?
The canonical SMILES for 2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine is FC(F)c1c(Cl)cc(Br)nc1Br.
What is the InChIKey of 2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine?
The InChIKey is BVAMXKOTSSNOKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2Br2ClF2N/c7-3-1-2(9)4(6(10)11)5(8)12-3/h1,6H.
What are the key properties of 2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine?
2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine has a molecular weight of 321.35 g/mol, XLogP of 4.20, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine is sourced from PubChem (CID 118834001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).