2-[2-(pyridin-2-yl)diazen-1-yl]pyridine

• ChemBase ID: 795927
• Molecular Formular: C10H8N4
• Molecular Mass: 184.19732
• Monoisotopic Mass: 184.07489628
• SMILES: N(=Nc1ncccc1)c1ncccc1
• Canonical SMILES: c1ccc(nc1)N=Nc1ccccn1
• InChI: InChI=1S/C10H8N4/c1-3-7-11-9(5-1)13-14-10-6-2-4-8-12-10/h1-8H
• InChIKey: VJTJVFFICHLTKX-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-[2-(pyridin-2-yl)diazen-1-yl]pyridine
• IUPAC Traditional name: 2-[2-(pyridin-2-yl)diazen-1-yl]pyridine
• Synonyms: Pyridine, 2,2'-(1,2-diazenediyl)bis-

Database IDs

• CAS Number: 2633-03-6

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): 3.1327085
• LogD (pH = 7.4): 3.1327097
• Log P: 3.1327097
• Molar Refractivity: 56.6902 cm^3
• Polarizability: 19.778755 Å^3
• Polar Surface Area: 50.5 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 97%; 98%