2,4-dichloro-6-methoxypyridine

• ChemBase ID: 290205
• Molecular Formular: C6H5Cl2NO
• Molecular Mass: 178.016
• Monoisotopic Mass: 176.97481915
• SMILES: COc1cc(Cl)cc(Cl)n1
• Canonical SMILES: COc1cc(Cl)cc(n1)Cl
• InChI: InChI=1S/C6H5Cl2NO/c1-10-6-3-4(7)2-5(8)9-6/h2-3H,1H3
• InChIKey: DHWHMXYTPKDBSY-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,4-dichloro-6-methoxypyridine
• IUPAC Traditional name: 2,4-dichloro-6-methoxypyridine
• Synonyms: 2,4-Dichloro-6-methoxypyridine

Database IDs

• CAS Number: 1227572-43-1
• PubChem SID: 180675736
• PubChem CID: 59872472

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 2.6206262
• LogD (pH = 7.4): 2.6206262
• Log P: 2.6206262
• Molar Refractivity: 41.3487 cm^3
• Polarizability: 15.863936 Å^3
• Polar Surface Area: 22.12 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%