Diisodecyl Phthalate-d4

CAS: 1346604-79-2

Ref. TR-D455217

Product Information

• Name: Diisodecyl Phthalate-d4
• Synonyms: 1,2-Benzene-3,4,5,6-d4-dicarboxylic acid, 1,2-bis(8-methylnonyl) ester, Phthalic Acid Di-isodecyl Ester (3,4,5,6)-D4
• Brand: TRC

Description

Applications A labelled phtalate ester found in plastic gasket used in food packaging. Used in environmental toxicology studies as a present contaminant.
Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package
References Novak, J. et al.: Env. Toxicol. Chem., 26, 1591 (2007); Yu, Y. et al.: Ship. Gong. Keji, 29, 243 (2008);

Chemical properties

• Molecular weight: 450.69
• Formula: C₂₈₂H₄H₄₂O₄
• Color/Form: Neat
• InChI: InChI=1S/C28H46O4/c1-23(2)17-11-7-5-9-15-21-31-27(29)25-19-13-14-20-26(25)28(30)32-22-16-10-6-8-12-18-24(3)4/h13-14,19-20,23-24H,5-12,15-18,21-22H2,1-4H3/i13D,14D,19D,20D
• InChI key: InChIKey=ZVFDTKUVRCTHQE-OLNJRPQYSA-N
• SMILES: [2H]c1c([2H])c([2H])c(C(=O)OCCCCCCCC(C)C)c(C(=O)OCCCCCCCC(C)C)c1[2H]