2-[[1-Amino-7-[[5-[(4,6-Dichloro-1,3,5-Triazin-2-Yl)Amino]-2-Sulphophenyl]Azo]-8-Hydroxy-3,6-Disulpho-2-Naphthyl]Azo]Naphthalene-1,5-Disulphonic Acid
[CAS# 64253-81-2]

Identification

• Name: 2-[[1-Amino-7-[[5-[(4,6-Dichloro-1,3,5-Triazin-2-Yl)Amino]-2-Sulphophenyl]Azo]-8-Hydroxy-3,6-Disulpho-2-Naphthyl]Azo]Naphthalene-1,5-Disulphonic Acid
• Synonyms: (3Z)-5-Amino-3-[[5-[(4,6-Dichloro-1,3,5-Triazin-2-Yl)Amino]-2-Sulfo-Phenyl]Hydrazono]-6-[(1,5-Disulfo-2-Naphthyl)Azo]-4-Oxo-Naphthalene-2,7-Disulfonic Acid; (3Z)-5-Amino-3-[[5-[(4,6-Dichloro-1,3,5-Triazin-2-Yl)Amino]-2-Sulfophenyl]Hydrazono]-6-[(1,5-Disulfo-2-Naphthyl)Azo]-4-Oxonaphthalene-2,7-Disulfonic Acid; (3Z)-5-Amino-3-[[5-[(4,6-Dichloro-S-Triazin-2-Yl)Amino]-2-Sulfo-Phenyl]Hydrazono]-6-[(1,5-Disulfo-2-Naphthyl)Azo]-4-Keto-Naphthalene-2,7-Disulfonic Acid
• Molecular Formula: C₂₉H₁₉Cl₂N₉O₁₆S₅
• Molecular Weight: 980.73
• CAS Registry Number: 64253-81-2
• EINECS: 264-758-6
• SMILES: C1=C6C(=C(N)C(=C1[S](O)(=O)=O)N=NC3=C([S](O)(=O)=O)C2=C(C(=CC=C2)[S](O)(=O)=O)C=C3)C(=O)C(=N/NC4=C([S](O)(=O)=O)C=CC(=C4)NC5=NC(=NC(=N5)Cl)Cl)/C(=C6)[S](O)(=O)=O
• InChI: 1S/C29H19Cl2N9O16S5/c30-27-34-28(31)36-29(35-27)33-12-4-7-18(58(45,46)47)16(10-12)38-40-24-20(60(51,52)53)9-11-8-19(59(48,49)50)23(22(32)21(11)25(24)41)39-37-15-6-5-13-14(26(15)61(54,55)56)2-1-3-17(13)57(42,43)44/h1-10,38H,32H2,(H,42,43,44)(H,45,46,47)(H,48,49,50)(H,51,52,53)(H,54,55,56)(H,33,34,35,36)/b39-37?,40-24+
• InChIKey: NDBMAKXDEYONSC-PJBSINFASA-N

Properties

• Density: 2.113g/cm³ (Cal.)