6-chloro-8-fluoroimidazo[1,2-a]pyridine

• ChemBase ID: 290574
• Molecular Formular: C7H4ClFN2
• Molecular Mass: 170.5714632
• Monoisotopic Mass: 170.00470404
• SMILES: Fc1cc(Cl)cn2c1ncc2
• Canonical SMILES: Clc1cc(F)c2n(c1)ccn2
• InChI: InChI=1S/C7H4ClFN2/c8-5-3-6(9)7-10-1-2-11(7)4-5/h1-4H
• InChIKey: ICYMCPKHCXZHDA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 6-chloro-8-fluoroimidazo[1,2-a]pyridine
• IUPAC Traditional name: 6-chloro-8-fluoroimidazo[1,2-a]pyridine
• Synonyms: 6-Chloro-8-fluoroimidazo[1,2-a]pyridine

Database IDs

• CAS Number: 1033202-10-6
• PubChem SID: 180676105
• PubChem CID: 46738826

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 1.3806028
• LogD (pH = 7.4): 1.5044073
• Log P: 1.506296
• Molar Refractivity: 40.9576 cm^3
• Polarizability: 14.936152 Å^3
• Polar Surface Area: 17.3 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%