5-(Acetylamino)-4-Hydroxy-3-[[2-Methoxy-5-[[2-(Sulphooxy)Ethyl]Sulphonyl]Phenyl]Azo]Naphthalene-2,7-Disulphonic Acid
[CAS# 10116-15-1]

Identification

• Name: 5-(Acetylamino)-4-Hydroxy-3-[[2-Methoxy-5-[[2-(Sulphooxy)Ethyl]Sulphonyl]Phenyl]Azo]Naphthalene-2,7-Disulphonic Acid
• Synonyms: (3E)-5-Acetamido-3-[[2-Methoxy-5-(2-Sulfooxyethylsulfonyl)Phenyl]Hydrazono]-4-Oxo-Naphthalene-2,7-Disulfonic Acid; (3E)-5-Acetamido-3-[[2-Methoxy-5-(2-Sulfooxyethylsulfonyl)Phenyl]Hydrazono]-4-Oxonaphthalene-2,7-Disulfonic Acid; (3E)-5-Acetamido-4-Keto-3-[[2-Methoxy-5-(2-Sulfoxyethylsulfonyl)Phenyl]Hydrazono]Naphthalene-2,7-Disulfonic Acid
• Molecular Formula: C₂₁H₂₁N₃O₁₅S₄
• Molecular Weight: 683.65
• CAS Registry Number: 10116-15-1
• EINECS: 233-319-0
• SMILES: C1=C([S](O)(=O)=O)C=C(NC(=O)C)C3=C1C=C([S](O)(=O)=O)/C(=N/NC2=C(OC)C=CC(=C2)[S](=O)(=O)CCO[S](O)(=O)=O)C3=O
• InChI: 1S/C21H21N3O15S4/c1-11(25)22-16-10-14(41(29,30)31)7-12-8-18(42(32,33)34)20(21(26)19(12)16)24-23-15-9-13(3-4-17(15)38-2)40(27,28)6-5-39-43(35,36)37/h3-4,7-10,23H,5-6H2,1-2H3,(H,22,25)(H,29,30,31)(H,32,33,34)(H,35,36,37)/b24-20-
• InChIKey: CAGCLAILGFFZFN-GFMRDNFCSA-N

Properties

• Density: 1.813g/cm³ (Cal.)