5-fluoro-2-(2-methoxyethoxy)pyridine

• ChemBase ID: 290888
• Molecular Formular: C8H10FNO2
• Molecular Mass: 171.1689032
• Monoisotopic Mass: 171.06955679
• SMILES: COCCOc1ncc(F)cc1
• Canonical SMILES: COCCOc1ccc(cn1)F
• InChI: InChI=1S/C8H10FNO2/c1-11-4-5-12-8-3-2-7(9)6-10-8/h2-3,6H,4-5H2,1H3
• InChIKey: DFSYOWPLGXRNLV-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 5-fluoro-2-(2-methoxyethoxy)pyridine
• IUPAC Traditional name: 5-fluoro-2-(2-methoxyethoxy)pyridine
• Synonyms: 5-Fluoro-2-(2-methoxyethoxy)pyridine

Database IDs

• CAS Number: 1305322-91-1
• PubChem SID: 180676419
• PubChem CID: 54758831

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 1.2880841
• LogD (pH = 7.4): 1.288086
• Log P: 1.288086
• Molar Refractivity: 41.9377 cm^3
• Polarizability: 16.067097 Å^3
• Polar Surface Area: 31.35 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%