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. 2024 May 28;98(7):2153–2171. doi: 10.1007/s00204-024-03738-x

Table 1.

Structures and identifiers relating to DiPeP mixture components, alongside the products of their esterase-mediated primary metabolism

ID Name Structure CAS Chemical form Status
Diisopentyl phthalate (mixture) See below 84777-06-0 Phthalate diester

Composition:

Substance 1 (85%)

Substance 2 (15%)

1 Bis(3-methylbutyl) phthalate graphic file with name 204_2024_3738_Figa_HTML.gif 605-50-5 Phthalate diester

Major mixture component:

May be marketed alone as diisopentyl phthalate

2 Di(2-methylbutyl) phthalate graphic file with name 204_2024_3738_Figb_HTML.gif 68951-39-3 Phthalate diester Minor mixture component
3 Monoisopentyl phthalate graphic file with name 204_2024_3738_Figc_HTML.gif 17866-76-1 Phthalate monoester Putative primary metabolite of 1
4 Isopentanol graphic file with name 204_2024_3738_Figd_HTML.gif 123-51-3 Alkyl alcohol Putative primary metabolite of 1
5 Mono(2-methylbutyl) phthalate graphic file with name 204_2024_3738_Fige_HTML.gif Phthalate monoester Putative primary metabolite of 2
6 2-Methyl-1-butanol graphic file with name 204_2024_3738_Figf_HTML.gif 137-32-6 Alkyl alcohol Putative primary metabolite of 2