2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine

C6H2BrCl2F2N — CID 119019803

IUPAC2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine
SMILESFC(F)c1c(Cl)cnc(Br)c1Cl
InChIInChI=1S/C6H2BrCl2F2N/c7-5-4(9)3(6(10)11)2(8)1-12-5/h1,6H
InChIKeyLIXVYJIASJBYDM-UHFFFAOYSA-N
MW276.89 g/mol
LogP4.09
Rot. Bonds1

About 2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine

2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine (PubChem CID 119019803) has the molecular formula C6H2BrCl2F2N and a molecular weight of 276.89 g/mol. Its IUPAC name is 2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine.

Molecular Properties

Compound Name2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine
PubChem CID119019803
Molecular FormulaC6H2BrCl2F2N
Molecular Weight276.89 g/mol
Exact Mass274.87
IUPAC Name2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine
SMILESFC(F)c1c(Cl)cnc(Br)c1Cl
InChIInChI=1S/C6H2BrCl2F2N/c7-5-4(9)3(6(10)11)2(8)1-12-5/h1,6H
InChIKeyLIXVYJIASJBYDM-UHFFFAOYSA-N
XLogP4.09
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.89
LogP ≤ 54.09
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-5-chloro-4-(difluoromethyl)pyridin-3-ol
CID 130107825
6-bromo-5-chloro-4-(difluoromethyl)pyridine-3-carbonitrile
CID 130107758
3,5-dichloro-4-(difluoromethyl)-2-methoxypyridine
CID 130099252
2-bromo-4-chloro-5-(chloromethyl)-3-(difluoromethyl)pyridine
CID 119022825
4,5-dichloro-3-(difluoromethyl)pyridin-2-amine
CID 119024495
5-chloro-4-(difluoromethyl)-2,3-diiodopyridine
CID 130100430
6-bromo-4-chloro-5-(difluoromethyl)pyridine-3-sulfonamide
CID 119001281
2-(bromomethyl)-5-chloro-4-(difluoromethyl)-3-fluoropyridine
CID 130071734
2-bromo-3-chloro-5-(difluoromethyl)pyridine-4-carboxamide
CID 118999675
2,6-dibromo-4-chloro-3-(difluoromethyl)pyridine
CID 118834001
2-bromo-4-(difluoromethyl)pyridine-3,5-diol
CID 118999212
methyl 2-[3,5-dichloro-4-(difluoromethyl)-2-pyridinyl]acetate
CID 134683841

Frequently Asked Questions

What is the IUPAC name of 2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine?
The IUPAC name of 2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine (CID 119019803) is 2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine.
What is the SMILES notation for 2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine?
The canonical SMILES for 2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine is FC(F)c1c(Cl)cnc(Br)c1Cl.
What is the InChIKey of 2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine?
The InChIKey is LIXVYJIASJBYDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2BrCl2F2N/c7-5-4(9)3(6(10)11)2(8)1-12-5/h1,6H.
What are the key properties of 2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine?
2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine has a molecular weight of 276.89 g/mol, XLogP of 4.09, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine is sourced from PubChem (CID 119019803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).