3-Oxohexanedioic Acid

CAS: 689-31-6

Ref. TR-O856825

Product Information

• Name: 3-Oxohexanedioic Acid
• Synonyms: 3-Ketoadipic Acid, 3-Oxoadipic Acid, NSC 18511, ß-Ketoadipic Acid, ß-Oxoadipic Acid, 3-Ketoadipic acid, 3-Oxohexanedioate, 3-Oxohexanedioic acid, B-ketoadipic acid, Hexanedioic acid, 3-oxo-, β-Oxoadipic acid

Description

Applications 3-Oxohexanedioic Acid is a degradation product of catechol in the presence of hydrogen peroxide; Also, it is derived from 3-Oxohexanedioic Acid Diethyl Ester (O856830), which is an intermediate used to prepare CMPF (C595000) which is a drug-binding inhibitor which is also a constituent of urine. CMPF can inhibit specific T4 binding in serum by increasing the free concentration of direct competitors.
References Gogoi, A., et al.: Chem. Eng. J., 311, 153-162 (2017); Mabuchi, H., Nakahashi, H.: Nephron, 44, 277 (1986); Lim, C.F., et. al.: Metabolism Clin. Exp., 42, 1468 (1993)

• Brand: TRC

Chemical properties

• Molecular weight: 160.125
• Formula: C₆H₈O₅
• Color/Form: Off White Solid
• InChI: InChI=1S/C6H8O5/c7-4(3-6(10)11)1-2-5(8)9/h1-3H2,(H,8,9)(H,10,11)
• InChI key: InChIKey=RTGHRDFWYQHVFW-UHFFFAOYSA-N
• SMILES: O=C(O)CCC(=O)CC(=O)O