Description
1,3-Dioxo-2,3-dihydro-1H-isoindol-2-yl 2-(4-chlorophenyl)acetate (CAS No. 402608-04-2) is a high-purity synthetic organic compound with the molecular formula C16H10ClNO4. This specialized chemical features a unique isoindole-1,3-dione (phthalimide) core esterified with a 2-(4-chlorophenyl)acetate moiety, making it valuable for advanced organic synthesis and pharmaceutical research. The compound’s molecular weight of 315.71 g/mol and precise structural configuration ensure consistent performance in demanding applications. Available in quantities from milligrams to bulk scale, our product undergoes rigorous QC testing including HPLC, NMR, and mass spectrometry to guarantee ≥95% purity. Proper storage at 2-8°C in airtight containers is recommended to maintain stability. This chemical is intended for research purposes only and not for human or veterinary use.
Properties
- CAS Number: 402608-04-2
- Complexity: 449
- IUPAC Name: (1,3-dioxoisoindolin-2-yl) 2-(4-chlorophenyl)acetate
- InChI: InChI=1S/C16H10ClNO4/c17-11-7-5-10(6-8-11)9-14(19)22-18-15(20)12-3-1-2-4-13(12)16(18)21/h1-8H,9H2
- InChI Key: PRPOKJGWRJNQJB-UHFFFAOYSA-N
- Exact Mass: 315.0298355
- Molecular Formula: C16H10ClNO4
- Molecular Weight: 315.71
- SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)OC(=O)CC3=CC=C(C=C3)Cl
- Topological: 63.7
- Monoisotopic Mass: 315.0298355
- Synonyms: 402608-04-2, 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 2-(4-chlorophenyl)acetate, 981-656-3, 1,3-Dioxoisoindolin-2-yl 2-(4-chlorophenyl)acetate, MFCD02032067, F71971, EN300-6514262, (1,3-dioxoisoindol-2-yl) 2-(4-chlorophenyl)acetate
Application
This compound serves as a versatile building block in medicinal chemistry, particularly for developing novel phthalimide-based drug candidates with potential anti-inflammatory or anticancer properties. Researchers utilize it as a key intermediate in synthesizing complex heterocyclic systems for pharmaceutical screening. The chlorophenyl moiety provides opportunities for further functionalization in structure-activity relationship studies. It has shown utility in designing protease inhibitors and enzyme modulators in biochemical research.
Safety and Hazards
GHS Hazard Statements
- H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
- H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
- H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
- H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statements
- P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Hazard Classes and Categories
- Acute Tox. 4 (100%)
- Skin Irrit. 2 (100%)
- Eye Irrit. 2A (100%)
- STOT SE 3 (100%)
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Disclaimer: Sold exclusively for laboratory research. Prohibited for commercial use, diagnostics, or human/animal applications. Buyers assume all compliance liability.


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