2,6-dibromo-4-chloropyridine

• ChemBase ID: 290890
• Molecular Formular: C5H2Br2ClN
• Molecular Mass: 271.33708
• Monoisotopic Mass: 268.82425075
• SMILES: Clc1cc(Br)nc(Br)c1
• Canonical SMILES: Clc1cc(Br)nc(c1)Br
• InChI: InChI=1S/C5H2Br2ClN/c6-4-1-3(8)2-5(7)9-4/h1-2H
• InChIKey: ZDPXTYKMHYSMQW-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,6-dibromo-4-chloropyridine
• IUPAC Traditional name: 2,6-dibromo-4-chloropyridine
• Synonyms: 2,6-Dibromo-4-chloropyridine

Database IDs

• CAS Number: 1196156-59-8
• PubChem SID: 180676421
• PubChem CID: 20280769

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 3.3081675
• LogD (pH = 7.4): 3.3081675
• Log P: 3.3081675
• Molar Refractivity: 45.6359 cm^3
• Polarizability: 17.543213 Å^3
• Polar Surface Area: 12.89 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%; 98%