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

• ChemBase ID: 293393
• Molecular Formular: C9H8N2O
• Molecular Mass: 160.17262
• Monoisotopic Mass: 160.06366289
• SMILES: O=Cc1cn2cccc(C)c2n1
• Canonical SMILES: O=Cc1cn2c(n1)c(C)ccc2
• InChI: InChI=1S/C9H8N2O/c1-7-3-2-4-11-5-8(6-12)10-9(7)11/h2-6H,1H3
• InChIKey: ZUQFHQQPWQVWSO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

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

Database IDs

• CAS Number: 143982-39-2
• PubChem SID: 180678924
• PubChem CID: 11094924

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 1.5378491
• LogD (pH = 7.4): 1.6582267
• Log P: 1.6600163
• Molar Refractivity: 47.1764 cm^3
• Polarizability: 16.952442 Å^3
• Polar Surface Area: 34.37 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%