Description

1,3-Dioxoisoindolin-2-yl hexanoate (CAS No. 2170596-50-4) is a high-purity organic compound with the molecular formula C₁₄H₁₅NO₄ and IUPAC name (1,3-dioxoisoindol-2-yl) hexanoate. This specialized chemical features a phthalimide core esterified with hexanoic acid, offering unique reactivity for synthetic applications. Our product is rigorously characterized by HPLC, NMR, and mass spectrometry to ensure ≥95% purity, packaged under inert atmosphere for maximum stability. Ideal for pharmaceutical intermediates, polymer chemistry, and materials science research. Available in research (100mg-1g) and bulk (5g-100g) quantities with optional analytical certificates.

• CAS: 2170596-50-4
• Molecular Weight: 261.27 g/mol
• Synonyms: SCHEMBL3676598, DB-374614
• Storage: -20°C under argon
• Handling: Moisture-sensitive

Properties

• CAS Number: 2170596-50-4
• Complexity: 356
• IUPAC Name: (1,3-dioxoisoindolin-2-yl) hexanoate
• InChI: InChI=1S/C14H15NO4/c1-2-3-4-9-12(16)19-15-13(17)10-7-5-6-8-11(10)14(15)18/h5-8H,2-4,9H2,1H3
• InChI Key: LYRPHZOWRJZWOU-UHFFFAOYSA-N
• Exact Mass: 261.10010796
• Molecular Formula: C14H15NO4
• Molecular Weight: 261.27
• SMILES: CCCCCC(=O)ON1C(=O)C2=CC=CC=C2C1=O
• Topological: 63.7
• Monoisotopic Mass: 261.10010796
• Synonyms: 1,3-Dioxoisoindolin-2-yl hexanoate, 2170596-50-4, SCHEMBL3676598, MFCD32797715, DB-374614, EN300-6513175, 1,3-Dihydro-1,3-dioxo-2H-isoindol-2-yl hexanoate, 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl hexanoate

Application

This compound serves as a versatile building block in organic synthesis, particularly for creating phthalimide-protected intermediates in peptide mimetics. The hexanoate ester moiety enables lipophilic modification of active pharmaceutical ingredients (APIs) to enhance bioavailability. Researchers utilize it in controlled-release formulations and as a precursor for functionalized polymers with tailored degradation profiles.

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