3-(3-Methyl-5-Oxo-2H-Pyrazol-1(5H)-Yl)Naphthalene-1,5-Disulfonic Acid
[CAS# 6838-01-3]

Identification

• Name: 3-(3-Methyl-5-Oxo-2H-Pyrazol-1(5H)-Yl)Naphthalene-1,5-Disulfonic Acid
• Synonyms: 3-(5-Keto-3-Methyl-4H-Pyrazol-1-Yl)Naphthalene-1,5-Disulfonic Acid; Chemdiv1_017500; 1,5-Naphthalenedisulfonic Acid, 3-(4,5-Dihydro-3-Methyl-5-Oxo-1H-Pyrazol-1-Yl)-
• Molecular Formula: C₁₄H₁₂N₂O₇S₂
• Molecular Weight: 384.38
• CAS Registry Number: 6838-01-3
• EINECS: 229-926-5
• SMILES: C1=CC=C2C(=C1[S](=O)(=O)O)C=C(C=C2[S](=O)(=O)O)N3N=C(C)CC3=O
• InChI: 1S/C14H12N2O7S2/c1-8-5-14(17)16(15-8)9-6-11-10(13(7-9)25(21,22)23)3-2-4-12(11)24(18,19)20/h2-4,6-7H,5H2,1H3,(H,18,19,20)(H,21,22,23)
• InChIKey: ZDBIDERWCKMIAU-UHFFFAOYSA-N

Properties

• Density: 1.751g/cm³ (Cal.)