Trimethyl 1-methyl-1H-pyrrole-2,3,4-tricarboxylate

Base Information

• Chemical Name: Trimethyl 1-methyl-1H-pyrrole-2,3,4-tricarboxylate
• CAS No.: 23893-69-8
• Molecular Formula: C11H13NO6
• Molecular Weight: 255.227
• DSSTox Substance ID: DTXSID50497022
• Wikidata: Q82346322
• Mol file: 23893-69-8.mol

Synonyms:23893-69-8;Trimethyl 1-methyl-1H-pyrrole-2,3,4-tricarboxylate;DTXSID50497022

Chemical Property of Trimethyl 1-methyl-1H-pyrrole-2,3,4-tricarboxylate

Chemical Property:

• XLogP3: 0.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 255.07428713
• Heavy Atom Count: 18
• Complexity: 355

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C=C(C(=C1C(=O)OC)C(=O)OC)C(=O)OC

Technology Process of Trimethyl 1-methyl-1H-pyrrole-2,3,4-tricarboxylate

There total 4 articles about Trimethyl 1-methyl-1H-pyrrole-2,3,4-tricarboxylate 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: 25.0%

1,3-dimethyl-1H-pyrrole (10524-65-9) + dimethyl acetylenedicarboxylate (762-42-5) → dimethyl 4-methylphthalate (20116-65-8) + dimethyl 1-methyl-1H-pyrrole-3,4-dicarboxylate (73529-28-9) + trimethyl 5-methylbenzene-1,2,3-tricarboxylate (74986-25-7) + trimethyl 1-methyl-1H-pyrrole-2,3,4-tricarboxylate (23893-69-8)

Guidance literature:

In neat (no solvent); for 15h; Further byproducts given; Ambient temperature;

DOI:10.1021/jo01311a004

Reference yield: 25.0%

1,3-dimethyl-1H-pyrrole (10524-65-9) + dimethyl acetylenedicarboxylate (762-42-5) → dimethyl 4-methylphthalate (20116-65-8) + dimethyl (Z)-1,3-dimethyl-2-pyrrolyl-2-butenedioate (74985-94-7) + trimethyl 5-methylbenzene-1,2,3-tricarboxylate (74986-25-7) + trimethyl 1-methyl-1H-pyrrole-2,3,4-tricarboxylate (23893-69-8)

Guidance literature:

In neat (no solvent); for 15h; Further byproducts given; Ambient temperature;

DOI:10.1021/jo01311a004

Reference yield: 25.0%

1,3-dimethyl-1H-pyrrole (10524-65-9) + dimethyl acetylenedicarboxylate (762-42-5) → dimethyl 4-methylphthalate (20116-65-8) + trimethyl 5-methylbenzene-1,2,3-tricarboxylate (74986-25-7) + tetramethyl 3a,7a-dihydro-1,6-dimethylindole-2,3,3a,4-tetracarboxylate (74986-16-6) + trimethyl 1-methyl-1H-pyrrole-2,3,4-tricarboxylate (23893-69-8)

Guidance literature:

In neat (no solvent); for 15h; Further byproducts given; Ambient temperature;

DOI:10.1021/jo01311a004

upstream raw materials:

1,3-dimethyl-1H-pyrrole

dimethyl acetylenedicarboxylate

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