2-bromo-6-fluoroimidazo[1,2-a]pyridine

• ChemBase ID: 291105
• Molecular Formular: C7H4BrFN2
• Molecular Mass: 215.0224632
• Monoisotopic Mass: 213.95418836
• SMILES: Fc1cn2c(cc1)nc(Br)c2
• Canonical SMILES: Fc1ccc2n(c1)cc(n2)Br
• InChI: InChI=1S/C7H4BrFN2/c8-6-4-11-3-5(9)1-2-7(11)10-6/h1-4H
• InChIKey: OTKAHNIDJZFOAV-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-bromo-6-fluoroimidazo[1,2-a]pyridine
• IUPAC Traditional name: 2-bromo-6-fluoroimidazo[1,2-a]pyridine
• Synonyms: 2-Bromo-6-fluoroimidazo[1,2-a]pyridine

Database IDs

• CAS Number: 1060815-08-8
• MDL Number: MFCD10698610
• PubChem SID: 180676636
• PubChem CID: 40148003

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 1.7915432
• LogD (pH = 7.4): 1.875339
• Log P: 1.876526
• Molar Refractivity: 44.6178 cm^3
• Polarizability: 16.039242 Å^3
• Polar Surface Area: 17.3 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%