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Application Area
Environmental
Environmental

Stable isotope-labeled compounds are used as environmental pollutant standards for the detection of air, water, soil, sediment and food.

Clinical diagnostic
Clinical diagnostic

In addition to treating various diseases, isotopes are used for imaging, diagnosis, and newborn screening.

Organic Chemistry
Organic Chemistry

Small molecule compounds labeled with stable isotopes can be used as chemical reference for chemical identification, qualitative, quantitative, detection, etc. Various types of NMR solvents can be used to study the structure, reaction mechanism and reaction kinetics of compounds.

Metabolic Research
Metabolic Research

Stable isotope labeling allows researchers to study metabolic pathways in vivo in a safe manner.

Bis(2-ethylhexyl)phthalate-[d4]

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General Information
Catalog: BLP-000079
CAS: 93951-87-2
Molecular Formula: C24H34D4O4
Molecular Weight: 394.58
Chemical Structure
Bis(2-ethylhexyl)phthalate-[d4]
Description Bis(2-ethylhexyl)phthalate-[d4] is the deuterium labelled edition of Bis(2-ethylhexyl)phthalate. Bis(2-ethylhexyl) Phthalate plasticizer is used to impart softness and flexibility to PVC products.
Synonyms DEHP-3,4,5,6-d4; Deuterated DEHP; Deuterated bis(2-ethylhexyl)phthalate; Dioctyl phthalate-3,4,5,6-d4; Phthalic acid-3,4,5,6-d4 bis(2-ethylhexyl ester); Bis(2-ethylhexyl)phthalate-3,4,5,6-d4
IUPAC Name bis(2-ethylhexyl) 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylate
Related CAS 117-81-7 (unlabelled)
Isomeric SMILES [2H]C1=C(C(=C(C(=C1[2H])C(=O)OCC(CC)CCCC)C(=O)OCC(CC)CCCC)[2H])[2H]
Canonical SMILES CCCCC(CC)COC(=O)C1=CC=CC=C1C(=O)OCC(CC)CCCC
InChI InChI=1S/C24H38O4/c1-5-9-13-19(7-3)17-27-23(25)21-15-11-12-16-22(21)24(26)28-18-20(8-4)14-10-6-2/h11-12,15-16,19-20H,5-10,13-14,17-18H2,1-4H3/i11D,12D,15D,16D
InChI Key BJQHLKABXJIVAM-SAQXESPHSA-N
Boiling Point 231 °C at 5 mmHg (lit.)
Melting Point -50 °C (lit.)
Purity 99% (CP); 98% atom D
Density 0.996 g/mL at 25 °C
Solubility Soluble in Chloroform, Ethyl Acetate, Methanol
Appearance Clear Colorless Oil
Storage Store at -20°C
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