2-[(2-{2-[1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetoxy}benzoyl)oxy]benzoic acid
[CAS# 86811-46-3]

Identification

• Name: 2-[(2-{2-[1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetoxy}benzoyl)oxy]benzoic acid
• Synonyms: 1H-INDOLE-3-ACETIC ACID, 1-(4-CHLOROBENZOYL)-5-METHOXY-2-METHYL-2-((2-CARBOXYPHE; TB 220
• Molecular Formula: C₃₃H₂₄ClNO₈
• Molecular Weight: 598.00
• CAS Registry Number: 86811-46-3
• SMILES: O=C(O)c5ccccc5OC(=O)c4ccccc4OC(=O)Cc2c1cc(OC)ccc1n(c2C)C(=O)c3ccc(Cl)cc3
• InChI: 1S/C33H24ClNO8/c1-19-25(26-17-22(41-2)15-16-27(26)35(19)31(37)20-11-13-21(34)14-12-20)18-30(36)42-29-10-6-4-8-24(29)33(40)43-28-9-5-3-7-23(28)32(38)39/h3-17H,18H2,1-2H3,(H,38,39)
• InChIKey: HSTCMJJFYYQQRG-UHFFFAOYSA-N

Properties

• Density: 1.345g/cm³ (Cal.)
• Boiling point: 763.782°C at 760 mmHg (Cal.)
• Flash point: 415.721°C (Cal.)