4-Chloro-3-({[(2,4-Dibromo-6-Methylphenoxy)Acetyl]Carbamothioyl}Amino)Benzoic Acid
[CAS# 531535-40-7]

Identification

• Name: 4-Chloro-3-({[(2,4-Dibromo-6-Methylphenoxy)Acetyl]Carbamothioyl}Amino)Benzoic Acid
• Molecular Formula: C₁₇H₁₃Br₂ClN₂O₄S
• Molecular Weight: 536.62
• CAS Registry Number: 531535-40-7
• SMILES: Brc2cc(Br)cc(c2OCC(=O)NC(=S)Nc1cc(C(=O)O)ccc1Cl)C
• InChI: 1S/C17H13Br2ClN2O4S/c1-8-4-10(18)6-11(19)15(8)26-7-14(23)22-17(27)21-13-5-9(16(24)25)2-3-12(13)20/h2-6H,7H2,1H3,(H,24,25)(H2,21,22,23,27)
• InChIKey: JOBLXALKNHMFNV-UHFFFAOYSA-N

Properties

• Density: 1.823g/cm³ (Cal.)
• Refractive index: 1.704 (Cal.)