5-bromo-8-methoxyquinoline hydrochloride

• ChemBase ID: 310277
• Molecular Formular: C10H9BrClNO
• Molecular Mass: 274.54156
• Monoisotopic Mass: 272.95560359
• SMILES: c12c(nccc2)c(ccc1Br)OC.Cl
• Canonical SMILES: COc1ccc(c2c1nccc2)Br.Cl
• InChI: InChI=1S/C10H8BrNO.ClH/c1-13-9-5-4-8(11)7-3-2-6-12-10(7)9;/h2-6H,1H3;1H
• InChIKey: MWEKVRSNTZUJDM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 5-bromo-8-methoxyquinoline hydrochloride
• IUPAC Traditional name: 5-bromo-8-methoxyquinoline hydrochloride
• Synonyms: 5-bromo-8-methoxyquinoline hydrochloride

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 2.7418056
• LogD (pH = 7.4): 2.7419796
• Log P: 2.7419817
• Molar Refractivity: 54.0653 cm^3
• Polarizability: 22.162767 Å^3
• Polar Surface Area: 22.12 Å^2