Indomethacin Ethoxycarbonylmethyl Ester
[CAS# 76812-43-6]

Identification

• Name: Indomethacin Ethoxycarbonylmethyl Ester
• Synonyms: (2-Ethoxy-2-Oxo-Ethyl) 2-[1-(4-Chlorobenzoyl)-5-Methoxy-2-Methyl-Indol-3-Yl]Acetate; 2-[1-[(4-Chlorophenyl)-Oxomethyl]-5-Methoxy-2-Methyl-3-Indolyl]Acetic Acid (2-Ethoxy-2-Oxoethyl) Ester; 2-[1-(4-Chlorobenzoyl)-5-Methoxy-2-Methyl-Indol-3-Yl]Acetic Acid (2-Ethoxy-2-Keto-Ethyl) Ester
• Molecular Formula: C₂₃H₂₂ClNO₆
• Molecular Weight: 443.88
• CAS Registry Number: 76812-43-6
• SMILES: C1=CC(=CC=C1C([N]2C(=C(CC(OCC(OCC)=O)=O)C3=CC(=CC=C23)OC)C)=O)Cl
• InChI: 1S/C23H22ClNO6/c1-4-30-22(27)13-31-21(26)12-18-14(2)25(20-10-9-17(29-3)11-19(18)20)23(28)15-5-7-16(24)8-6-15/h5-11H,4,12-13H2,1-3H3
• InChIKey: LJPQBEUXEDLQEJ-UHFFFAOYSA-N

Properties

• Density: 1.283g/cm³ (Cal.)
• Boiling point: 532.003°C at 760 mmHg (Cal.)
• Flash point: 275.546°C (Cal.)