6-chloroimidazo[1,2-b]pyridazine hydrochloride

• ChemBase ID: 87641
• Molecular Formular: C6H5Cl2N3
• Molecular Mass: 190.03
• Monoisotopic Mass: 188.98605254
• SMILES: n1c(ccc2nccn12)Cl.Cl
• Canonical SMILES: Clc1ccc2n(n1)ccn2.Cl
• InChI: InChI=1S/C6H4ClN3.ClH/c7-5-1-2-6-8-3-4-10(6)9-5;/h1-4H;1H
• InChIKey: BSHQWSFYUQCQMB-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 6-chloroimidazo[1,2-b]pyridazine hydrochloride
• IUPAC Traditional name: 6-chloroimidazo[1,2-b]pyridazine hydrochloride
• Synonyms: 6-Chloroimidazo[1,2-b]pyridazine hydrochloride 98%; 6-Chloroimidazo[1,2-b]pyridazine hydrochloride

Database IDs

• CAS Number: 13493-79-3
• MDL Number: MFCD09258637
• PubChem SID: 162074681
• PubChem CID: 44119181

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 1.4727149
• LogD (pH = 7.4): 1.4771377
• Log P: 1.4771944
• Molar Refractivity: 49.6397 cm^3
• Polarizability: 14.376621 Å^3
• Polar Surface Area: 30.19 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: Irritant

Product Information

• Purity: 95+%