Description

1,3-Dioxoisoindolin-2-yl 2-ethylhexanoate (CAS No. 1872262-63-9) is a high-purity specialty chemical with the molecular formula C₁₆H₁₉NO₄. This compound, also known by its IUPAC name (1,3-dioxoisoindol-2-yl) 2-ethylhexanoate, features a unique molecular structure combining an isoindoline-1,3-dione (phthalimide) moiety with a 2-ethylhexanoate ester group. It is supplied as a solid or semi-solid material with consistent batch-to-batch quality, making it ideal for research applications requiring precise chemical properties. Suitable for use in organic synthesis, pharmaceutical research, and material science, this compound is handled under strict quality control measures to ensure purity and stability. Store in a cool, dry place away from direct sunlight and incompatible substances.

Properties

• CAS Number: 1872262-63-9
• Complexity: 397
• IUPAC Name: (1,3-dioxoisoindolin-2-yl) 2-ethylhexanoate
• InChI: InChI=1S/C16H19NO4/c1-3-5-8-11(4-2)16(20)21-17-14(18)12-9-6-7-10-13(12)15(17)19/h6-7,9-11H,3-5,8H2,1-2H3
• InChI Key: QOFDEYBYBBYXGG-UHFFFAOYSA-N
• Exact Mass: 289.13140809
• Molecular Formula: C16H19NO4
• Molecular Weight: 289.33
• SMILES: CCCCC(CC)C(=O)ON1C(=O)C2=CC=CC=C2C1=O
• Topological: 63.7
• Monoisotopic Mass: 289.13140809
• Synonyms: 1,3-Dioxoisoindolin-2-yl 2-ethylhexanoate, 1872262-63-9, SCHEMBL13479723, MFCD34705634, (1,3-dioxoisoindol-2-yl) 2-ethylhexanoate, F71861, EN300-6513672, 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 2-ethylhexanoate

Application

1,3-Dioxoisoindolin-2-yl 2-ethylhexanoate serves as a versatile intermediate in organic synthesis, particularly in the development of pharmaceutical compounds and specialty materials. Its unique structure makes it valuable for constructing complex molecules in medicinal chemistry research. The compound may also find use in polymer chemistry as a modifying agent or functional monomer. Researchers employ it in the study of esterification reactions and heterocyclic compound behavior.

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