2-methoxy-6-phenylpyridine

• ChemBase ID: 290783
• Molecular Formular: C12H11NO
• Molecular Mass: 185.22184
• Monoisotopic Mass: 185.08406398
• SMILES: COc1nc(c2ccccc2)ccc1
• Canonical SMILES: COc1cccc(n1)c1ccccc1
• InChI: InChI=1S/C12H11NO/c1-14-12-9-5-8-11(13-12)10-6-3-2-4-7-10/h2-9H,1H3
• InChIKey: KIOFCYRHFIMVPM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-methoxy-6-phenylpyridine
• IUPAC Traditional name: 2-methoxy-6-phenylpyridine
• Synonyms: 2-Methoxy-6-phenylpyridine

Database IDs

• CAS Number: 35070-08-7
• PubChem SID: 180676314
• PubChem CID: 11469488

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 3.2251322
• LogD (pH = 7.4): 3.2254314
• Log P: 3.2254353
• Molar Refractivity: 55.442 cm^3
• Polarizability: 22.982082 Å^3
• Polar Surface Area: 22.12 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%