138220-90-3

Basic information

• Product Name: (1,3-DIOXO-OCTAHYDRO-ISOINDOL-2-YL)-ACETIC ACID
• Synonyms: 2-(1,3-Dioxohexahydro-1H-isoindol-2(3H)-yl)acetic acid;2-(1,3-dioxo-octahydro-1H-isoindol-2-yl)acetic acid
• CAS NO: 138220-90-3
• Molecular Formula: C₁₀H₁₃NO₄
• Molecular Weight: 211.22
• Mol File: 138220-90-3.mol

Chemical Properties

• Melting Point: 89.0-90.0 °C(Solv: toluene (108-88-3))
• Boiling Point: 473.6°Cat760mmHg
• Flash Point: 240.2°C
• Appearance: /
• Density: g/cm³
• Vapor Pressure: 2.82E-10mmHg at 25°C
• Refractive Index: 1.545
• PKA: 3.75±0.10(Predicted)
• CAS DataBase Reference: (1,3-DIOXO-OCTAHYDRO-ISOINDOL-2-YL)-ACETIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: (1,3-DIOXO-OCTAHYDRO-ISOINDOL-2-YL)-ACETIC ACID(138220-90-3)
• EPA Substance Registry System: (1,3-DIOXO-OCTAHYDRO-ISOINDOL-2-YL)-ACETIC ACID(138220-90-3)

Safety Data

• HazardClass: IRRITANT
• Hazardous Substances Data: 138220-90-3(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
(1,3-DIOXO-OCTAHYDRO-ISOINDOL-2-YL)-ACETIC ACID is used as a building block for the synthesis of various drugs and pharmaceuticals. Its versatile reactivity allows for the introduction of different chemical groups, making it a valuable intermediate in the development of new medications.
Used in Agrochemicals Industry:
(1,3-DIOXO-OCTAHYDRO-ISOINDOL-2-YL)-ACETIC ACID has potential applications in the agrochemicals industry, where it can be utilized as a starting material for the synthesis of various agrochemical products.
Used in Materials Science:
(1,3-DIOXO-OCTAHYDRO-ISOINDOL-2-YL)-ACETIC ACID also has potential applications in materials science, where its unique properties and reactivity can be harnessed for the development of new materials with specific characteristics.

InChI:InChI=1/C10H13NO4/c12-8(13)5-11-9(14)6-3-1-2-4-7(6)10(11)15/h6-7H,1-5H2,(H,12,13)

Upstream product

• 56-40-6 glycine 
• 85-42-7 1,2-Cyclohexanedicarboxylic acid-anhydride 

Downstream Products

• 510764-02-0 2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione 
• 1287060-71-2 2-{2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione 
• 1334385-63-5 2-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione 
• 1334385-64-6 2-{2-[4-(2,3-dichlorophenyl)piperazin-1-yl]-2-oxoethyl}-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione 
• 510764-03-1 2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione 
• 1334385-65-7 2-{2-[4-(3-trifluoromethylphenyl)piperazin-1-yl]-2-oxoethyl}-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione 

Relevant articles and documents

Synthesis and anticonvulsant properties of new acetamide derivatives of phthalimide, and its saturated cyclohexane and norbornene analogs

The synthesis and anticonvulsant properties of new piperazine or morpholine acetamides derived from 2-(1,3-dioxoisoindolin-2-yl)-, 2-(1,3-dioxo-3a,4,5,6,7, 7a-hexahydroisoindol-2-yl-) and (3,5-dioxo-4-azatricyclo[5.2.1.0 2,6]dec-8-en-4-yl)-acetic acid were described. Initial anticonvulsant screening was performed using maximal electroshock (MES) and subcutaneous pentylenetetrazole (scPTZ) seizures tests. The neurotoxicity was determined applying the minimal motor impairment rotarod test. The in vivo results revealed that numerous compounds were effective in the MES screen. The most active was 2-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}isoindoline-1,3-dione (12) that revealed protection in the electrically induced seizures at a dose of 30 mg/kg and 100 mg/kg 0.5 h and 4 h after i.p. administration in mice respectively. This molecule given orally in rats at a dose of 30 mg/kg was more potent than reference anticonvulsant - phenytoin.