(2-ethoxynaphthalen-1-yl)({2-methyl-4-[2-(2-methylphenyl)diazen-1-yl]phenyl})diazene

• ChemBase ID: 139142
• Molecular Formular: C26H24N4O
• Molecular Mass: 408.49496
• Monoisotopic Mass: 408.19501141
• SMILES: CCOc1ccc2ccccc2c1/N=N/c1ccc(cc1C)/N=N/c1ccccc1C
• Canonical SMILES: CCOc1ccc2c(c1/N=N/c1ccc(cc1C)/N=N/c1ccccc1C)cccc2
• InChI: InChI=1S/C26H24N4O/c1-4-31-25-16-13-20-10-6-7-11-22(20)26(25)30-29-24-15-14-21(17-19(24)3)27-28-23-12-8-5-9-18(23)2/h5-17H,4H2,1-3H3
• InChIKey: SFCSVWUXCUGLFH-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2-ethoxynaphthalen-1-yl)({2-methyl-4-[2-(2-methylphenyl)diazen-1-yl]phenyl})diazene
• IUPAC Traditional name: (2-ethoxynaphthalen-1-yl)({2-methyl-4-[2-(2-methylphenyl)diazen-1-yl]phenyl})diazene
• Synonyms: 1-(2-Methyl-4-o-tolylazo-phenylazo)-2-ethoxy-naphthalene; Sudan 410

Database IDs

• MDL Number: MFCD03458639
• PubChem SID: 162233390; 24880245
• PubChem CID: 4411028

CALCULATED PROPERTIES

• H Acceptors: 5
• H Donor: 0
• LogD (pH = 5.5): 9.000485
• LogD (pH = 7.4): 9.000489
• Log P: 9.000489
• Molar Refractivity: 132.4404 cm^3
• Polarizability: 48.26266 Å^3
• Polar Surface Area: 58.67 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Apperance: solid
• Melting Point: 97.6-99.6 °C(lit.)
• Absorption Wavelength: λmax 205 nm in methanol

Safety Information

• German water hazard class: 3
• Personal Protective Equipment: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

Product Information

• Compostion: Dye content, ~95%
• Empirical Formula (Hill Notation): C26H24N4O