5-(Acetylamino)-4-Hydroxy-3-[(3-Phosphonophenyl)Azo]Naphthalene-2,7-Disulphonic Acid
[CAS# 62346-00-3]

Identification

• Name: 5-(Acetylamino)-4-Hydroxy-3-[(3-Phosphonophenyl)Azo]Naphthalene-2,7-Disulphonic Acid
• Synonyms: (3E)-5-Acetamido-4-Oxo-3-[(3-Phosphonophenyl)Hydrazono]Naphthalene-2,7-Disulfonic Acid; (3E)-5-Acetamido-4-Keto-3-[(3-Phosphonophenyl)Hydrazono]Naphthalene-2,7-Disulfonic Acid; 5-(Acetylamino)-4-Hydroxy-3-((3-Phosphonophenyl)Azo)Naphthalene-2,7-Disulphonic Acid
• Molecular Formula: C₁₈H₁₆N₃O₁₁PS₂
• Molecular Weight: 545.43
• CAS Registry Number: 62346-00-3
• EINECS: 263-517-2
• SMILES: C1=C([S](O)(=O)=O)C=C(NC(=O)C)C3=C1C=C([S](O)(=O)=O)/C(=N/NC2=CC(=CC=C2)[P](O)(O)=O)C3=O
• InChI: 1S/C18H16N3O11PS2/c1-9(22)19-14-8-13(34(27,28)29)5-10-6-15(35(30,31)32)17(18(23)16(10)14)21-20-11-3-2-4-12(7-11)33(24,25)26/h2-8,20H,1H3,(H,19,22)(H2,24,25,26)(H,27,28,29)(H,30,31,32)/b21-17-
• InChIKey: KNLXABFCQFZYLZ-FXBPSFAMSA-N

Properties

• Density: 1.87g/cm³ (Cal.)