4-hydrazinylquinoline hydrochloride

• ChemBase ID: 25053
• Molecular Formular: C9H10ClN3
• Molecular Mass: 195.6488
• Monoisotopic Mass: 195.05632502
• SMILES: c12c(NN)ccnc1cccc2.Cl
• Canonical SMILES: NNc1ccnc2c1cccc2.Cl
• InChI: InChI=1S/C9H9N3.ClH/c10-12-9-5-6-11-8-4-2-1-3-7(8)9;/h1-6H,10H2,(H,11,12);1H
• InChIKey: WRAUKLFJWHVIGP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-hydrazinylquinoline hydrochloride
• IUPAC Traditional name: 4-hydrazinylquinoline hydrochloride
• Synonyms: 4-Hydrazinoquinoline hydrochloride

Database IDs

• MDL Number: MFCD01861876
• PubChem SID: 160988360
• PubChem CID: 17750639

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): 0.7801341
• LogD (pH = 7.4): 1.4932239
• Log P: 1.5225431
• Molar Refractivity: 49.686 cm^3
• Polarizability: 19.559862 Å^3
• Polar Surface Area: 50.94 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: IRRITANT; Irritant/Air Sensitive/Store Cold
• TSCA Listed: false