Disperse Blue 94
[CAS 12235-96-0]

Identification

• Name: Disperse Blue 94
• Synonyms: N-[2-(2-Bromo-4,6-Dinitro-Phenyl)Azo-5-(2-Cyanoethyl-(2-Hydroxyethyl)Amino)-4-Methoxy-Phenyl]Acetamide; N-[2-(2-Bromo-4,6-Dinitrophenyl)Azo-5-(2-Cyanoethyl-(2-Hydroxyethyl)Amino)-4-Methoxyphenyl]Acetamide; N-[2-(2-Bromo-4,6-Dinitro-Phenyl)Diazenyl-5-(2-Cyanoethyl-(2-Hydroxyethyl)Amino)-4-Methoxy-Phenyl]Ethanamide
• Molecular Formula: C₂₀H₂₀BrN₇O₇
• Molecular Weight: 550.32
• CAS Registry Number: 12235-96-0
• SMILES: C1=C(NC(C)=O)C(=CC(=C1N(CCC#N)CCO)OC)N=NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])Br
• InChI: 1S/C20H20BrN7O7/c1-12(30)23-15-10-17(26(6-7-29)5-3-4-22)19(35-2)11-16(15)24-25-20-14(21)8-13(27(31)32)9-18(20)28(33)34/h8-11,29H,3,5-7H2,1-2H3,(H,23,30)
• InChIKey: MJEWVKATPDZNHU-UHFFFAOYSA-N