4-hydrazinyl-2,7-dimethylquinoline hydrochloride

• ChemBase ID: 805022
• Molecular Formular: C11H14ClN3
• Molecular Mass: 223.70196
• Monoisotopic Mass: 223.08762514
• SMILES: Cl.c1(cc2c(cc1)c(cc(n2)C)NN)C
• Canonical SMILES: NNc1cc(C)nc2c1ccc(c2)C.Cl
• InChI: InChI=1S/C11H13N3.ClH/c1-7-3-4-9-10(5-7)13-8(2)6-11(9)14-12;/h3-6H,12H2,1-2H3,(H,13,14);1H
• InChIKey: OXKBYBNDYHQRTA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-hydrazinyl-2,7-dimethylquinoline hydrochloride
• IUPAC Traditional name: 4-hydrazinyl-2,7-dimethylquinoline hydrochloride
• Synonyms: 2,7-DIMETHYL-4-HYDRAZINOQUINOLINE HYDROCHLORIDE

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): 0.5083064
• LogD (pH = 7.4): 1.9977098
• Log P: 2.1673346
• Molar Refractivity: 59.3187 cm^3
• Polarizability: 23.0872 Å^3
• Polar Surface Area: 50.94 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%