Cibacron Blue 3G-A
[CAS# 84166-13-2]

Identification

• Classification: API >> Antibiotics >> Other antibiotics
• Name: Cibacron Blue 3G-A
• Synonyms: 1-Amino-4-[[4-[[4-Chloro-6-[(2-Sulfophenyl)Amino]-1,3,5-Triazin-2-Yl]Amino]-3-Sulfo-Phenyl]Amino]-9,10-Dioxo-Anthracene-2-Sulfonic Acid; 1-Amino-4-[[4-[[4-Chloro-6-[(2-Sulfophenyl)Amino]-1,3,5-Triazin-2-Yl]Amino]-3-Sulfophenyl]Amino]-9,10-Dioxo-2-Anthracenesulfonic Acid; 1-Amino-4-[[4-[[4-Chloro-6-[(2-Sulfophenyl)Amino]-S-Triazin-2-Yl]Amino]-3-Sulfo-Phenyl]Amino]-9,10-Diketo-Anthracene-2-Sulfonic Acid
• Molecular Formula: C₂₉H₂₀ClN₇O₁₁S₃
• Molecular Weight: 774.15
• CAS Registry Number: 84166-13-2
• SMILES: C1=CC=CC3=C1C(=O)C2=C(C(=CC(=C2C3=O)NC4=CC=C(C(=C4)[S](O)(=O)=O)NC5=NC(=NC(=N5)Cl)NC6=C([S](O)(=O)=O)C=CC=C6)[S](O)(=O)=O)N
• InChI: 1S/C29H20ClN7O11S3/c30-27-35-28(33-16-7-3-4-8-19(16)49(40,41)42)37-29(36-27)34-17-10-9-13(11-20(17)50(43,44)45)32-18-12-21(51(46,47)48)24(31)23-22(18)25(38)14-5-1-2-6-15(14)26(23)39/h1-12,32H,31H2,(H,40,41,42)(H,43,44,45)(H,46,47,48)(H2,33,34,35,36,37)
• InChIKey: YKCWQPZFAFZLBI-UHFFFAOYSA-N

Properties

• Density: 1.846g/cm³ (Cal.)