2-(((4-Methyl-7-oxyooctyl)oxy)carbonyl)cyclohexanecarboxylic Acid (Mixture of Diastereomers)

CAS: 1588520-62-0

Ref. TR-M329200

Produktinformation

• Name: 2-(((4-Methyl-7-oxyooctyl)oxy)carbonyl)cyclohexanecarboxylic Acid (Mixture of Diastereomers)
• Synonyme: 2-(4-methyl-7-oxo-octoxy)carbonylcyclohexanecarboxylic acid

Beschreibung

Applications 2-(((4-Methyl-7-oxyooctyl)oxy)carbonyl)cyclohexanecarboxylic Acid is a secondary oxidized metabolite of the di(isononyl)cyclohexane-1,2-dicarboxylate (DINCH) monoester (MINCH) and may be used as biomarkers of DINCH exposure. DINCH is a major substitute for some high molecular weight phthalates that adversely affect reproductive function.
References Schutze, A., et. al.: J. Chromatogr. B Analyt. Technol. Biomed. Life Sci., 895, 123 (2012)

• Marke: TRC

Chemische Eigenschaften

• Molekulargewicht: 312.40
• Formel: C₁₇H₂₈O₅
• Farbe/Form: Neat
• InChl: InChI=1S/C17H28O5/c1-12(9-10-13(2)18)6-5-11-22-17(21)15-8-4-3-7-14(15)16(19)20/h12,14-15H,3-11H2,1-2H3,(H,19,20)
• InChI Key: InChIKey=GDOQGHAKQNDFFH-UHFFFAOYSA-N
• SMILES: CC(=O)CCC(C)CCCOC(=O)C1CCCCC1C(=O)O