3-bromo-6-chloro-2,4-dimethylpyridine

C7H7BrClN — CID 71464351

IUPAC3-bromo-6-chloro-2,4-dimethylpyridine
SMILESCc1cc(Cl)nc(C)c1Br
InChIInChI=1S/C7H7BrClN/c1-4-3-6(9)10-5(2)7(4)8/h3H,1-2H3
InChIKeyPOWYUKKERVLNDN-UHFFFAOYSA-N
MW220.50 g/mol
LogP3.11
Rot. Bonds

About 3-bromo-6-chloro-2,4-dimethylpyridine

3-bromo-6-chloro-2,4-dimethylpyridine (PubChem CID 71464351) has the molecular formula C7H7BrClN and a molecular weight of 220.50 g/mol. Its IUPAC name is 3-bromo-6-chloro-2,4-dimethylpyridine.

Molecular Properties

Compound Name3-bromo-6-chloro-2,4-dimethylpyridine
PubChem CID71464351
Molecular FormulaC7H7BrClN
Molecular Weight220.50 g/mol
Exact Mass218.95
IUPAC Name3-bromo-6-chloro-2,4-dimethylpyridine
SMILESCc1cc(Cl)nc(C)c1Br
InChIInChI=1S/C7H7BrClN/c1-4-3-6(9)10-5(2)7(4)8/h3H,1-2H3
InChIKeyPOWYUKKERVLNDN-UHFFFAOYSA-N
XLogP3.11
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.50
LogP ≤ 53.11
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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Frequently Asked Questions

What is the IUPAC name of 3-bromo-6-chloro-2,4-dimethylpyridine?
The IUPAC name of 3-bromo-6-chloro-2,4-dimethylpyridine (CID 71464351) is 3-bromo-6-chloro-2,4-dimethylpyridine.
What is the SMILES notation for 3-bromo-6-chloro-2,4-dimethylpyridine?
The canonical SMILES for 3-bromo-6-chloro-2,4-dimethylpyridine is Cc1cc(Cl)nc(C)c1Br.
What is the InChIKey of 3-bromo-6-chloro-2,4-dimethylpyridine?
The InChIKey is POWYUKKERVLNDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7BrClN/c1-4-3-6(9)10-5(2)7(4)8/h3H,1-2H3.
What are the key properties of 3-bromo-6-chloro-2,4-dimethylpyridine?
3-bromo-6-chloro-2,4-dimethylpyridine has a molecular weight of 220.50 g/mol, XLogP of 3.11, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-6-chloro-2,4-dimethylpyridine is sourced from PubChem (CID 71464351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).