3-Amino-N-[5-oxo-1-(2,4,6-trichlorophenyl)-2,5-dihydro-1H-pyrazol-3-yl]benzamide
[CAS# 939889-30-2]

Identification

• Name: 3-Amino-N-[5-oxo-1-(2,4,6-trichlorophenyl)-2,5-dihydro-1H-pyrazol-3-yl]benzamide
• Synonyms: "1-(2,4,6-Trichlorophenyl)-3-(3- aminobenzamido) -5-pyrazolone "; 1-(2,4,6-trichlorophenyl)-3-(3-aminobenzamido)-5-pyrazolone; 3-amino-N-(5-oxo-1-(2,4,6-trichlorophenyl)-2,5-dihydro-1H-pyrazol-3-yl)benzamide
• Molecular Formula: C₁₆H₁₁Cl₃N₄O₂
• Molecular Weight: 397.64
• CAS Registry Number: 939889-30-2
• SMILES: Clc1c(c(Cl)cc(Cl)c1)N3C(=O)/C=C(/NC(=O)c2cccc(N)c2)N3
• InChI: 1S/C16H11Cl3N4O2/c17-9-5-11(18)15(12(19)6-9)23-14(24)7-13(22-23)21-16(25)8-2-1-3-10(20)4-8/h1-7,22H,20H2,(H,21,25)
• InChIKey: KYHZKDSABHBQNC-UHFFFAOYSA-N

Properties

• Density: 1.644g/cm³ (Cal.)
• Refractive index: 1.736 (Cal.)