3,5-Dibromo-2-{[(2-Iodobenzoyl)Carbamothioyl]Amino}Benzoic Acid
[CAS# 530126-93-3]

Identification

• Name: 3,5-Dibromo-2-{[(2-Iodobenzoyl)Carbamothioyl]Amino}Benzoic Acid
• Molecular Formula: C₁₅H₉Br₂IN₂O₃S
• Molecular Weight: 584.02
• CAS Registry Number: 530126-93-3
• SMILES: Brc2cc(Br)cc(c2NC(=S)NC(=O)c1ccccc1I)C(=O)O
• InChI: 1S/C15H9Br2IN2O3S/c16-7-5-9(14(22)23)12(10(17)6-7)19-15(24)20-13(21)8-3-1-2-4-11(8)18/h1-6H,(H,22,23)(H2,19,20,21,24)
• InChIKey: PGXCXHKVDLBGMD-UHFFFAOYSA-N

Properties

• Density: 2.199g/cm³ (Cal.)
• Refractive index: 1.781 (Cal.)