3-(4-chlorophenyl)-6-hydrazinylpyridazine

• ChemBase ID: 306501
• Molecular Formular: C10H9ClN4
• Molecular Mass: 220.65826
• Monoisotopic Mass: 220.05157399
• SMILES: n1nc(NN)ccc1c1ccc(cc1)Cl
• Canonical SMILES: NNc1ccc(nn1)c1ccc(cc1)Cl
• InChI: InChI=1S/C10H9ClN4/c11-8-3-1-7(2-4-8)9-5-6-10(13-12)15-14-9/h1-6H,12H2,(H,13,15)
• InChIKey: AZCTXHPEZWKVGD-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 3-(4-chlorophenyl)-6-hydrazinylpyridazine
• IUPAC Traditional name: 3-(4-chlorophenyl)-6-hydrazinylpyridazine
• Synonyms: 3-(4-chlorophenyl)-6-hydrazinopyridazine

Database IDs

• CAS Number: 60478-25-3
• MDL Number: MFCD07389029

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 2
• LogD (pH = 5.5): 2.117462
• LogD (pH = 7.4): 2.3940663
• Log P: 2.399024
• Molar Refractivity: 63.3536 cm^3
• Polarizability: 23.916676 Å^3
• Polar Surface Area: 63.83 Å^2