6-ethoxy-4-hydrazinylquinoline hydrochloride

• ChemBase ID: 805212
• Molecular Formular: C11H14ClN3O
• Molecular Mass: 239.70136
• Monoisotopic Mass: 239.08253976
• SMILES: Cl.c1cc2c(cc1OCC)c(ccn2)NN
• Canonical SMILES: CCOc1cc2c(NN)ccnc2cc1.Cl
• InChI: InChI=1S/C11H13N3O.ClH/c1-2-15-8-3-4-10-9(7-8)11(14-12)5-6-13-10;/h3-7H,2,12H2,1H3,(H,13,14);1H
• InChIKey: KWCSTCOKSPVHML-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 6-ethoxy-4-hydrazinylquinoline hydrochloride
• IUPAC Traditional name: 6-ethoxy-4-hydrazinylquinoline hydrochloride
• Synonyms: 4-HYDRAZINO-6-ETHOXYQUINOLINE HYDROCHLORIDE

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 2
• LogD (pH = 5.5): 0.72054553
• LogD (pH = 7.4): 1.6867864
• Log P: 1.7216798
• Molar Refractivity: 60.8978 cm^3
• Polarizability: 23.87832 Å^3
• Polar Surface Area: 60.17 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%