7-[[4-Chloro-6-[(3-Sulphophenyl)Amino]-1,3,5-Triazin-2-Yl]Amino]-4-Hydroxy-3-[(4-Methoxy-2-Sulphophenyl)Azo]Naphthalene-2-Sulphonic Acid
[CAS# 59641-46-2]

Identification

• Name: 7-[[4-Chloro-6-[(3-Sulphophenyl)Amino]-1,3,5-Triazin-2-Yl]Amino]-4-Hydroxy-3-[(4-Methoxy-2-Sulphophenyl)Azo]Naphthalene-2-Sulphonic Acid
• Synonyms: (3E)-7-[[4-Chloro-6-[(3-Sulfophenyl)Amino]-1,3,5-Triazin-2-Yl]Amino]-3-[(4-Methoxy-2-Sulfo-Phenyl)Hydrazono]-4-Oxo-Naphthalene-2-Sulfonic Acid; (3E)-7-[[4-Chloro-6-[(3-Sulfophenyl)Amino]-1,3,5-Triazin-2-Yl]Amino]-3-[(4-Methoxy-2-Sulfophenyl)Hydrazono]-4-Oxo-2-Naphthalenesulfonic Acid; (3E)-7-[[4-Chloro-6-[(3-Sulfophenyl)Amino]-S-Triazin-2-Yl]Amino]-4-Keto-3-[(4-Methoxy-2-Sulfo-Phenyl)Hydrazono]Naphthalene-2-Sulfonic Acid
• Molecular Formula: C₂₆H₂₀ClN₇O₁₁S₃
• Molecular Weight: 738.12
• CAS Registry Number: 59641-46-2
• EINECS: 261-833-5
• SMILES: C3=C(NC1=NC(=NC(=N1)NC2=CC(=CC=C2)[S](O)(=O)=O)Cl)C=CC5=C3C=C([S](O)(=O)=O)/C(=N/NC4=C([S](O)(=O)=O)C=C(OC)C=C4)C5=O
• InChI: 1S/C26H20ClN7O11S3/c1-45-16-6-8-19(20(12-16)47(39,40)41)33-34-22-21(48(42,43)44)10-13-9-15(5-7-18(13)23(22)35)29-26-31-24(27)30-25(32-26)28-14-3-2-4-17(11-14)46(36,37)38/h2-12,33H,1H3,(H,36,37,38)(H,39,40,41)(H,42,43,44)(H2,28,29,30,31,32)/b34-22-
• InChIKey: QVDHSPJZLOISAH-VQNDASPWSA-N

Properties

• Density: 1.822g/cm³ (Cal.)