bis(naphthalen-1-yl)diazene

• ChemBase ID: 107775
• Molecular Formular: C20H14N2
• Molecular Mass: 282.33856
• Monoisotopic Mass: 282.11569846
• SMILES: c1ccc2c(cccc2/N=N/c2cccc3c2cccc3)c1
• Canonical SMILES: c1ccc2c(c1)c(ccc2)/N=N/c1cccc2c1cccc2
• InChI: InChI=1S/C20H14N2/c1-3-11-17-15(7-1)9-5-13-19(17)21-22-20-14-6-10-16-8-2-4-12-18(16)20/h1-14H
• InChIKey: ICIDZHMCYAIUIJ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: bis(naphthalen-1-yl)diazene
• IUPAC Traditional name: di-naphthalen-1-yl-diazene
• Synonyms: 1,1'-AZONAPHTHALENE

Database IDs

• CAS Number: 487-10-5
• EC Number: 207-648-5
• PubChem SID: 162093791
• PubChem CID: 10247

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 6.358092
• LogD (pH = 7.4): 6.358093
• Log P: 6.358093
• Molar Refractivity: 93.2774 cm^3
• Polarizability: 36.86409 Å^3
• Polar Surface Area: 24.72 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• RTECS: CO1400000

DETAILS

MP Biomedicals - 05204996

MP Biomedicals Rare Chemical collection