106352-01-6

Basic information

• Product Name: 3-(1,3-DIOXO-1,3-DIHYDRO-ISOINDOL-2-YLMETHYL)-BENZOIC ACID
• Synonyms: 3-((1,3-Dioxoisoindolin-2-yl)Methyl)benzoic acid;Benzoic acid,3-[(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)Methyl]-;3-[(1,3-Dihydro-1,3-dioxo-2H-isoindol-2-yl)methyl]benzoic acid
• CAS NO: 106352-01-6
• Molecular Formula: C₁₆H₁₁NO₄
• Molecular Weight: 281.26
• Mol File: 106352-01-6.mol
• Article Data: 5

Chemical Properties

• Melting Point: 177-183 °C
• Boiling Point: 511.4°Cat760mmHg
• Flash Point: 263.1°C
• Appearance: /
• Density: 1.454g/cm³
• Vapor Pressure: 2.79E-11mmHg at 25°C
• Storage Temp.: Inert atmosphere,Room Temperature
• PKA: 4.17±0.10(Predicted)
• CAS DataBase Reference: 3-(1,3-DIOXO-1,3-DIHYDRO-ISOINDOL-2-YLMETHYL)-BENZOIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(1,3-DIOXO-1,3-DIHYDRO-ISOINDOL-2-YLMETHYL)-BENZOIC ACID(106352-01-6)
• EPA Substance Registry System: 3-(1,3-DIOXO-1,3-DIHYDRO-ISOINDOL-2-YLMETHYL)-BENZOIC ACID(106352-01-6)

Safety Data

• Hazardous Substances Data: 106352-01-6(Hazardous Substances Data)

Usage

General Description

3-(1,3-dioxo-1,3-dihydro-isoindol-2-ylmethyl)-benzoic acid is a chemical compound with potential pharmaceutical and industrial applications. It is a benzoic acid derivative that contains a 1,3-dioxo-1,3-dihydro-isoindol-2-ylmethyl group. 3-(1,3-DIOXO-1,3-DIHYDRO-ISOINDOL-2-YLMETHYL)-BENZOIC ACID may exhibit biological activities and is of interest in drug discovery and development. It has the potential to be used as a building block in the synthesis of various organic compounds, including pharmaceuticals and agrochemicals. Research on this chemical may reveal its potential applications in medicine, biology, and various other industries.

InChI:InChI=1/C16H11NO4/c18-14-12-6-1-2-7-13(12)15(19)17(14)9-10-4-3-5-11(8-10)16(20)21/h1-8H,9H2,(H,20,21)/p-1

Upstream product

• 136918-14-4 phthalimide 
• 118-29-6 2-(hydroxymethyl)-1H-isoindole-1,3(2H)-dione 
• 65-85-0 benzoic acid 

Downstream Products

• 155873-30-6 m-phthalimidomethyl-p-acetylbenzanilide 
• 952424-11-2 3-(1,3-dioxo-1,3-dihydro-isoindol-2-ylmethyl)-benzaldehyde 
• 875557-17-8 3-(1,3-Dioxo-1,3-dihydro-isoindol-2-ylmethyl)-benzoic acid [1-phenyl-meth-(E)-ylidene]-hydrazide 
• 875557-11-2 3-(1,3-dioxo-1,3-dihydro-isoindol-2-ylmethyl)-benzoic acid hydrazide 
• 491836-78-3 2-(3-hydroxymethyl-benzyl)-isoindole-1,3-dione 
• 186606-12-2 3-(1,3-Dioxo-1,3-dihydro-isoindol-2-ylmethyl)-benzoyl chloride 

Relevant articles and documents

Design and synthesis of a biologically active antibody mimic based on an antibody-antigen crystal structure

We have used the crystal structure of an N9 sialidase (antigen)-NC41 (antibody) complex to design a low molecular weight compound that mimics the binding function of the macromolecular antibody. The components of recognition between the antibody and the protein antigen have been analyzed from the energy-refined crystal complex. From this analysis, four amino acid residues on the antibody binding surface, which make direct contact with the active-site loop 368-370 of the antigen, have been identified as contributing the majority of the binding energy of the protein. The designed target compound, a constrained cyclic peptide, which mimics the receptor-bound conformation of these amino acids, has been synthesized and found to inhibit N9 sialidase activity, with a K(i) of 1 x 10-4 M.

Synthesis, characterization and biological activity of 1,3,4-substituted 2-azetidinones

Amido/imido alcohol/2-phenyl-3-hydroxyethylquinazolin-4 (3H) -one 1 on treatment with benzoic acid in the presence of cone. H2SO4 yields m-(aralkylamido/imidoalkyl/2-phenyl-3-ethyl-3H-4-oxoquinazolinyl) benzoic acids 2. The acid chloride of 2 on reaction with hydrazine hydrate affords m-(aralkylamido/imidoalkyl/2-phenyl-3-ethyl-3H-4-oxo-quinazolinyl) benzoic acid hydrazides 4 which on condensation with an aromatic aldehyde in acetic acid gives m-(aralkylamido/imidoalkyl/2-phenyl-3-ethyl-3H-4-oxo- quinazolinyl) benzoic acid hydrazones 5. Compounds 5 undergo cyclization with phenoxy acetic acid in the presence of thionyl chloride in dry benzene to furnish 1-[m-(aralkylamido/imidoalkyl/2-phenyl-3-ethyl-3H-4-oxo-quinazolinyl- benzamido)]-3-phenoxy-4-phenyl-2-azetidinones 6. The antiviral and antifungal activities of 6 have been reported.

Synthesis of some m-(Phthalimidoalkyl)-4-substituted-cinnamoylbenzanilides and Study of their Hypoglycemic Activities

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