Methyl oxindole-7-carboxylate

Base Information

• Chemical Name: Methyl oxindole-7-carboxylate
• CAS No.: 380427-39-4
• Molecular Formula: C10H9NO3
• Molecular Weight: 191.186
• Hs Code.: 2933790090
• European Community (EC) Number: 689-084-3
• DSSTox Substance ID: DTXSID80378517
• Wikidata: Q72494113
• Mol file: 380427-39-4.mol

Synonyms:380427-39-4;Methyl 2-oxoindoline-7-carboxylate;METHYL OXINDOLE-7-CARBOXYLATE;METHYL 2-OXO-2,3-DIHYDRO-1H-INDOLE-7-CARBOXYLATE;methyl 2-oxo-1,3-dihydroindole-7-carboxylate;MFCD02179610;1H-Indole-7-carboxylic acid, 2,3-dihydro-2-oxo-, methyl ester;SCHEMBL1639672;DTXSID80378517;AMY24578;RB3265;AKOS006229412;FS-3513;PB19984;AC-27819;SY013062;CS-0011499;A857876;Q-102623

Chemical Property of Methyl oxindole-7-carboxylate

Chemical Property:

• Vapor Pressure: 1.08E-06mmHg at 25°C
• Melting Point: 182-184 °C
• Refractive Index: 1.572
• Boiling Point: 402.7 °C at 760 mmHg
• PKA: 13.39±0.20(Predicted)
• Flash Point: 197.3 °C
• PSA: 55.40000
• Density: 1.283 g/cm³
• LogP: 1.10580
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly, Heated)
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 191.058243149
• Heavy Atom Count: 14
• Complexity: 264

Purity/Quality:

98%,99%, ^*data from raw suppliers

Methyl2-oxoindoline-7-carboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=CC=CC2=C1NC(=O)C2

Technology Process of Methyl oxindole-7-carboxylate

There total 1 articles about Methyl oxindole-7-carboxylate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

methyl 7-isatincarboxylate (103030-10-0) → methyl oxindole-7-carboxylate (380427-39-4)

Guidance literature:

methyl 7-isatincarboxylate; With hydrogen; palladium on activated charcoal; In ethanol;

With hydrogenchloride; hydrogen; palladium on activated charcoal; In ethanol; Further stages.;

DOI:10.1016/j.bmcl.2006.12.006

Reference yield: 57.0%

methyl oxindole-7-carboxylate (380427-39-4) + para-chlorotoluene (106-43-4) → methyl 2-oxo-3-p-tolylindoline-7-carboxylate (1042159-66-9)

Guidance literature:

With tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; potassium carbonate; XPhos; In tetrahydrofuran; at 80 ℃; for 24h; Inert atmosphere;

DOI:10.1021/ja803179s

Reference yield:

methyl oxindole-7-carboxylate (380427-39-4) → 2-oxoindoline-7-carboxylic acid (25369-43-1)

Guidance literature:

With sodium hydroxide; In methanol;

DOI:10.1016/j.bmcl.2006.12.006

upstream raw materials:

methyl 7-isatincarboxylate

Downstream raw materials:

2-oxoindoline-7-carboxylic acid

methyl 2-oxo-3-p-tolylindoline-7-carboxylate

Refernces