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

C6H2Br2ClF2N — CID 130098856

IUPAC3,4-dibromo-6-chloro-2-(difluoromethyl)pyridine
SMILESFC(F)c1nc(Cl)cc(Br)c1Br
InChIInChI=1S/C6H2Br2ClF2N/c7-2-1-3(9)12-5(4(2)8)6(10)11/h1,6H
InChIKeyCZJSXEVMTBTENS-UHFFFAOYSA-N
MW321.35 g/mol
LogP4.20
Rot. Bonds1

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

3,4-dibromo-6-chloro-2-(difluoromethyl)pyridine (PubChem CID 130098856) has the molecular formula C6H2Br2ClF2N and a molecular weight of 321.35 g/mol. Its IUPAC name is 3,4-dibromo-6-chloro-2-(difluoromethyl)pyridine.

Molecular Properties

Compound Name3,4-dibromo-6-chloro-2-(difluoromethyl)pyridine
PubChem CID130098856
Molecular FormulaC6H2Br2ClF2N
Molecular Weight321.35 g/mol
Exact Mass318.82
IUPAC Name3,4-dibromo-6-chloro-2-(difluoromethyl)pyridine
SMILESFC(F)c1nc(Cl)cc(Br)c1Br
InChIInChI=1S/C6H2Br2ClF2N/c7-2-1-3(9)12-5(4(2)8)6(10)11/h1,6H
InChIKeyCZJSXEVMTBTENS-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

3,6-dichloro-4-(chloromethyl)-2-(difluoromethyl)pyridine
CID 130099341
4-(bromomethyl)-6-chloro-2-(difluoromethyl)-3-iodopyridine
CID 130073150
5-bromo-4-chloro-6-(difluoromethyl)pyridine-2-carbonyl chloride
CID 130108417
3-bromo-6-(chloromethyl)-2-(difluoromethyl)-4-iodopyridine
CID 130068320
5-bromo-2-chloro-6-(difluoromethyl)pyridin-3-ol
CID 130107859
3-bromo-5-chloro-6-(difluoromethyl)pyridin-2-amine
CID 119012391
2-bromo-3-chloro-5-(chloromethyl)-6-(difluoromethyl)pyridine
CID 118995980
4-(aminomethyl)-6-chloro-2-(difluoromethyl)pyridin-3-amine
CID 130102649
3-bromo-4-(chloromethyl)-2-(difluoromethyl)-6-methoxypyridine
CID 130068793
6-chloro-2-(difluoromethyl)-3-hydroxypyridine-4-sulfonamide
CID 130072903
6-chloro-2-(difluoromethyl)-4-iodopyridine-3-sulfonamide
CID 130073584
6-chloro-2-(difluoromethyl)-4-iodo-3-(trifluoromethyl)pyridine
CID 130073209

Frequently Asked Questions

What is the IUPAC name of 3,4-dibromo-6-chloro-2-(difluoromethyl)pyridine?
The IUPAC name of 3,4-dibromo-6-chloro-2-(difluoromethyl)pyridine (CID 130098856) is 3,4-dibromo-6-chloro-2-(difluoromethyl)pyridine.
What is the SMILES notation for 3,4-dibromo-6-chloro-2-(difluoromethyl)pyridine?
The canonical SMILES for 3,4-dibromo-6-chloro-2-(difluoromethyl)pyridine is FC(F)c1nc(Cl)cc(Br)c1Br.
What is the InChIKey of 3,4-dibromo-6-chloro-2-(difluoromethyl)pyridine?
The InChIKey is CZJSXEVMTBTENS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2Br2ClF2N/c7-2-1-3(9)12-5(4(2)8)6(10)11/h1,6H.
What are the key properties of 3,4-dibromo-6-chloro-2-(difluoromethyl)pyridine?
3,4-dibromo-6-chloro-2-(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 3,4-dibromo-6-chloro-2-(difluoromethyl)pyridine is sourced from PubChem (CID 130098856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).