For research use only. Not for therapeutic Use.
Trioctyl trimellitate-d₆(CAT: I040229) is a deuterium-labeled analog of trioctyl trimellitate, a widely used plasticizer known for its high thermal stability and resistance to extraction. The incorporation of six deuterium atoms makes this compound ideal for use as an internal standard in analytical studies, including mass spectrometry and isotope-dilution techniques. It enables precise quantification and tracking of trioctyl trimellitate in complex matrices such as polymers, medical devices, and environmental samples. This stable isotope-labeled compound is especially valuable in studying plasticizer migration, degradation, and exposure pathways, supporting regulatory assessments and materials research across a range of industrial and environmental applications.
| Synonyms | tris(1,1-dideuterio-2-ethylhexyl) benzene-1,2,4-tricarboxylate |
| Molecular Formula | C33H48D6O6 |
| Purity | ≥95% |
| IUPAC Name | tris(1,1-dideuterio-2-ethylhexyl) benzene-1,2,4-tricarboxylate |
| InChI | InChI=1S/C33H54O6/c1-7-13-16-25(10-4)22-37-31(34)28-19-20-29(32(35)38-23-26(11-5)17-14-8-2)30(21-28)33(36)39-24-27(12-6)18-15-9-3/h19-21,25-27H,7-18,22-24H2,1-6H3/i22D2,23D2,24D2 |
| InChIKey | KRADHMIOFJQKEZ-NXJGFHQPSA-N |
| SMILES | CCCCC(CC)COC(=O)C1=CC(=C(C=C1)C(=O)OCC(CC)CCCC)C(=O)OCC(CC)CCCC |
| Chemistry Calculators | Dilution Calculator In vivo Formulation Calculator Molarity Calculator Molecular Weight Calculator Reconstitution Calculator |
