4-{[(3,5-Dibromo-2-Methoxybenzoyl)Carbamothioyl]Amino}Benzoic Acid
[CAS# 532945-45-2]

Identification

• Name: 4-{[(3,5-Dibromo-2-Methoxybenzoyl)Carbamothioyl]Amino}Benzoic Acid
• Molecular Formula: C₁₆H₁₂Br₂N₂O₄S
• Molecular Weight: 488.15
• CAS Registry Number: 532945-45-2
• SMILES: Brc1cc(Br)cc(c1OC)C(=O)NC(=S)Nc2ccc(C(=O)O)cc2
• InChI: 1S/C16H12Br2N2O4S/c1-24-13-11(6-9(17)7-12(13)18)14(21)20-16(25)19-10-4-2-8(3-5-10)15(22)23/h2-7H,1H3,(H,22,23)(H2,19,20,21,25)
• InChIKey: DVJMCUUDAGHRQT-UHFFFAOYSA-N

Properties

• Density: 1.825g/cm³ (Cal.)
• Refractive index: 1.717 (Cal.)