2,6-bis(benzyloxy)pyridine

• ChemBase ID: 290615
• Molecular Formular: C19H17NO2
• Molecular Mass: 291.34378
• Monoisotopic Mass: 291.12592879
• SMILES: c1(OCc2ccccc2)nc(OCc2ccccc2)ccc1
• Canonical SMILES: c1cc(OCc2ccccc2)nc(c1)OCc1ccccc1
• InChI: InChI=1S/C19H17NO2/c1-3-8-16(9-4-1)14-21-18-12-7-13-19(20-18)22-15-17-10-5-2-6-11-17/h1-13H,14-15H2
• InChIKey: IREZYNKPQCIUME-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,6-bis(benzyloxy)pyridine
• IUPAC Traditional name: 2,6-bis(benzyloxy)pyridine
• Synonyms: 2,6-Bis(benzyloxy)pyridine

Database IDs

• CAS Number: 16727-46-1
• PubChem SID: 180676146
• PubChem CID: 819936

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 5.0780525
• LogD (pH = 7.4): 5.0780916
• Log P: 5.078092
• Molar Refractivity: 86.6797 cm^3
• Polarizability: 33.67753 Å^3
• Polar Surface Area: 31.35 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: false

PROPERTIES

Product Information

• Purity: 95+%