3-bromo-2,4-dichloro-5,6-dimethylpyridine

C7H6BrCl2N — CID 169250788

IUPAC3-bromo-2,4-dichloro-5,6-dimethylpyridine
SMILESCc1nc(Cl)c(Br)c(Cl)c1C
InChIInChI=1S/C7H6BrCl2N/c1-3-4(2)11-7(10)5(8)6(3)9/h1-2H3
InChIKeyWSSWWXMCZYEXOT-UHFFFAOYSA-N
MW254.94 g/mol
LogP3.77
Rot. Bonds

About 3-bromo-2,4-dichloro-5,6-dimethylpyridine

3-bromo-2,4-dichloro-5,6-dimethylpyridine (PubChem CID 169250788) has the molecular formula C7H6BrCl2N and a molecular weight of 254.94 g/mol. Its IUPAC name is 3-bromo-2,4-dichloro-5,6-dimethylpyridine.

Molecular Properties

Compound Name3-bromo-2,4-dichloro-5,6-dimethylpyridine
PubChem CID169250788
Molecular FormulaC7H6BrCl2N
Molecular Weight254.94 g/mol
Exact Mass252.91
IUPAC Name3-bromo-2,4-dichloro-5,6-dimethylpyridine
SMILESCc1nc(Cl)c(Br)c(Cl)c1C
InChIInChI=1S/C7H6BrCl2N/c1-3-4(2)11-7(10)5(8)6(3)9/h1-2H3
InChIKeyWSSWWXMCZYEXOT-UHFFFAOYSA-N
XLogP3.77
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.94
LogP ≤ 53.77
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

5-bromo-6-chloro-2,4-dimethylpyridine-3-carboxylic acid
CID 83668119
1-bromo-3,4-dichloro-2,5,6-trimethylbenzene
CID 13202029
5,6-dichloro-2,4-dimethylpyridin-3-amine;ethane
CID 156715440
6-bromo-4-chloro-2,3,5,7-tetramethylquinoline
CID 107577474
1,2-dibromo-4,5-dichloro-3,6-dimethylbenzene
CID 3631184
2-chloro-3-iodo-4,5,6-trimethylpyridine
CID 131701568
2-chloro-4,5,6-trimethylpyrimidine
CID 12501987
2,4-dichloro-5,6-dimethylpyrimidine
CID 156777151
5-bromo-4-chloro-2-(1-chloroethyl)-6-methylpyrimidine
CID 80663394
5-bromo-2,4-dichloro-6-methyl-3-phenylpyridine
CID 59007781
5-bromo-4-chloro-6-methyl-2-propylpyrimidine
CID 66293537
1-(5-bromo-4-chloro-6-methylpyrimidin-2-yl)-N,N-dimethylmethanamine
CID 79077691

Frequently Asked Questions

What is the IUPAC name of 3-bromo-2,4-dichloro-5,6-dimethylpyridine?
The IUPAC name of 3-bromo-2,4-dichloro-5,6-dimethylpyridine (CID 169250788) is 3-bromo-2,4-dichloro-5,6-dimethylpyridine.
What is the SMILES notation for 3-bromo-2,4-dichloro-5,6-dimethylpyridine?
The canonical SMILES for 3-bromo-2,4-dichloro-5,6-dimethylpyridine is Cc1nc(Cl)c(Br)c(Cl)c1C.
What is the InChIKey of 3-bromo-2,4-dichloro-5,6-dimethylpyridine?
The InChIKey is WSSWWXMCZYEXOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrCl2N/c1-3-4(2)11-7(10)5(8)6(3)9/h1-2H3.
What are the key properties of 3-bromo-2,4-dichloro-5,6-dimethylpyridine?
3-bromo-2,4-dichloro-5,6-dimethylpyridine has a molecular weight of 254.94 g/mol, XLogP of 3.77, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2,4-dichloro-5,6-dimethylpyridine is sourced from PubChem (CID 169250788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).