5-bromo-2-(5-bromopyridin-2-yl)pyridine

• ChemBase ID: 289476
• Molecular Formular: C10H6Br2N2
• Molecular Mass: 313.97604
• Monoisotopic Mass: 311.8897722
• SMILES: Brc1cnc(cc1)c1ncc(Br)cc1
• Canonical SMILES: Brc1ccc(nc1)c1ccc(cn1)Br
• InChI: InChI=1S/C10H6Br2N2/c11-7-1-3-9(13-5-7)10-4-2-8(12)6-14-10/h1-6H
• InChIKey: JNWPRPLNUUMYCM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 5-bromo-2-(5-bromopyridin-2-yl)pyridine
• IUPAC Traditional name: 5-bromo-2-(5-bromopyridin-2-yl)pyridine
• Synonyms: 5,5'-Dibromo-2,2'-bipyridine

Database IDs

• CAS Number: 15862-18-7
• PubChem SID: 180675007
• PubChem CID: 10903103

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 3.4942827
• LogD (pH = 7.4): 3.4943316
• Log P: 3.4943323
• Molar Refractivity: 61.382 cm^3
• Polarizability: 25.096264 Å^3
• Polar Surface Area: 25.78 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%; 98%