imidazo[1,2-a]pyridine-8-carbaldehyde

• ChemBase ID: 293397
• Molecular Formular: C8H6N2O
• Molecular Mass: 146.14604
• Monoisotopic Mass: 146.04801282
• SMILES: O=Cc1cccn2c1ncc2
• Canonical SMILES: O=Cc1cccn2c1ncc2
• InChI: InChI=1S/C8H6N2O/c11-6-7-2-1-4-10-5-3-9-8(7)10/h1-6H
• InChIKey: NVRSZEFZHMVGRS-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: imidazo[1,2-a]pyridine-8-carbaldehyde
• IUPAC Traditional name: imidazo[1,2-a]pyridine-8-carbaldehyde
• Synonyms: Imidazo[1,2-a]pyridine-8-carbaldehyde

Database IDs

• CAS Number: 136117-74-3
• PubChem SID: 180678928
• PubChem CID: 10997174

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 0.15483247
• LogD (pH = 7.4): 0.46557972
• Log P: 0.47205177
• Molar Refractivity: 42.5204 cm^3
• Polarizability: 15.187506 Å^3
• Polar Surface Area: 34.37 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%