2-{[(3,5-Dibromo-2-Methoxybenzoyl)Carbamothioyl]Amino}Benzoic Acid
[CAS# 530138-44-4]

Identification

• Name: 2-{[(3,5-Dibromo-2-Methoxybenzoyl)Carbamothioyl]Amino}Benzoic Acid
• Molecular Formula: C₁₆H₁₂Br₂N₂O₄S
• Molecular Weight: 488.15
• CAS Registry Number: 530138-44-4
• SMILES: Brc1cc(Br)cc(c1OC)C(=O)NC(=S)Nc2ccccc2C(=O)O
• InChI: 1S/C16H12Br2N2O4S/c1-24-13-10(6-8(17)7-11(13)18)14(21)20-16(25)19-12-5-3-2-4-9(12)15(22)23/h2-7H,1H3,(H,22,23)(H2,19,20,21,25)
• InChIKey: LXCWVINUNNHVAW-UHFFFAOYSA-N

Properties

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