5-Carboxyhexyl Phthalate-d4

• CAT Number: R063988
• CAS Number: NA
• Molecular Formula: C₂₂H₂₆D₄O₈
• Molecular Weight: 426.49
• Purity: ≥95%
• Storage: -20°C
• IUPAC Name: 7-[2-(6-carboxyhexoxycarbonyl)-3,4,5,6-tetradeuteriobenzoyl]oxyheptanoic acid
• InChI: InChI=1S/C22H30O8/c23-19(24)13-5-1-3-9-15-29-21(27)17-11-7-8-12-18(17)22(28)30-16-10-4-2-6-14-20(25)26/h7-8,11-12H,1-6,9-10,13-16H2,(H,23,24)(H,25,26)/i7D,8D,11D,12D
• InChIKey: IBDXCYAVUYDHGI-CXRURWBMSA-N
• SMILES: C1=CC=C(C(=C1)C(=O)OCCCCCCC(=O)O)C(=O)OCCCCCCC(=O)O

5-Carboxyhexyl Phthalate-d4（Cat No.:R063988） is a deuterated version of 5-Carboxyhexyl Phthalate, where four hydrogen atoms are replaced with deuterium. This isotopic modification enhances the compound’s chemical stability, making it particularly useful for studies in environmental science and toxicology. 5-Carboxyhexyl Phthalate is a metabolite of phthalates, compounds often used as plasticizers and associated with potential health risks. The deuterated form allows for more accurate tracing and quantification of phthalate metabolites in biological and environmental samples, aiding in the assessment of exposure levels and understanding the degradation pathways and health impacts of phthalates.