Copper Tetrasodium 7-[(5-Chloro-6-Fluoro-2-Methylpyrimidin-4-Yl)Amino]-4-Oxido-3-(2-Oxido-4,6-Disulfonatonaphthalen-1-Yl)Diazenylnaphthalene-1,5-Disulfonate
[CAS# 75199-10-9]

Identification

• Name: Copper Tetrasodium 7-[(5-Chloro-6-Fluoro-2-Methylpyrimidin-4-Yl)Amino]-4-Oxido-3-(2-Oxido-4,6-Disulfonatonaphthalen-1-Yl)Diazenylnaphthalene-1,5-Disulfonate
• Synonyms: Copper Tetrasodium 7-[(5-Chloro-6-Fluoro-2-Methyl-Pyrimidin-4-Yl)Amino]-4-Oxido-3-[(2-Oxido-4,6-Disulfonato-1-Naphthyl)Azo]Naphthalene-1,5-Disulfonate; Copper Tetrasodium 7-[(5-Chloro-6-Fluoro-2-Methyl-4-Pyrimidinyl)Amino]-4-Oxido-3-[(2-Oxido-4,6-Disulfonato-1-Naphthyl)Azo]Naphthalene-1,5-Disulfonate; Cupric Tetrasodium 7-[(5-Chloro-6-Fluoro-2-Methyl-Pyrimidin-4-Yl)Amino]-4-Oxido-3-[(2-Oxido-4,6-Disulfonato-1-Naphthyl)Azo]Naphthalene-1,5-Disulfonate
• Molecular Formula: C₂₅H₁₁ClCuFN₅Na₄O₁₄S₄
• Molecular Weight: 943.58
• CAS Registry Number: 75199-10-9
• SMILES: C2=C([S]([O-])(=O)=O)C1=CC(=CC(=C1C(=C2N=NC3=C([O-])C=C([S]([O-])(=O)=O)C4=CC(=CC=C34)[S]([O-])(=O)=O)[O-])[S]([O-])(=O)=O)NC5=C(Cl)C(=NC(=N5)C)F.[Na+].[Na+].[Na+].[Cu++].[Na+]
• InChI: 1S/C25H17ClFN5O14S4.Cu.4Na/c1-9-28-24(27)21(26)25(29-9)30-10-4-14-17(48(38,39)40)7-15(23(34)20(14)19(5-10)50(44,45)46)31-32-22-12-3-2-11(47(35,36)37)6-13(12)18(8-16(22)33)49(41,42)43;;;;;/h2-8,33-34H,1H3,(H,28,29,30)(H,35,36,37)(H,38,39,40)(H,41,42,43)(H,44,45,46);;;;;/q;+2;4*+1/p-6
• InChIKey: KCTMVHKBTVHYRI-UHFFFAOYSA-H