Ethyl 4-chloro-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate

Base Information

Chemical Name:Ethyl 4-chloro-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
CAS No.:83798-51-0
Molecular Formula:C14H14ClNO2
Molecular Weight:263.724
Hs Code.:
DSSTox Substance ID:DTXSID40510370
Wikidata:Q82368610

Synonyms:Ethyl 4-chloro-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate;83798-51-0;SCHEMBL1156774;DTXSID40510370;GOERFJRUCOAQQL-UHFFFAOYSA-N

Suppliers and Price of Ethyl 4-chloro-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of Ethyl 4-chloro-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate

Chemical Property:

PSA：42.09000
LogP:3.82020
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:263.0713064
Heavy Atom Count:18
Complexity:292

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)C1=C(NC(=C1Cl)C2=CC=CC=C2)C

Technology Process of Ethyl 4-chloro-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate

There total 3 articles about Ethyl 4-chloro-2-methyl-5-phenyl-1H-pyrrole-3-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: 75.0%

: 3652-48-0
ethyl 2-methyl-5-phenyl-1H-pyrrole-3-carboxylate

: 83798-51-0
ethyl 4-chloro-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate

Guidance literature:: With N-chloro-succinimide; In N,N-dimethyl-formamide; at 100 ℃; for 1h;

Reference yield:

: 3652-48-0
ethyl 2-methyl-5-phenyl-1H-pyrrole-3-carboxylate

: 144-55-8
sodium hydrogencarbonate

: 83798-51-0
ethyl 4-chloro-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate

Guidance literature:: With N-chloro-succinimide; In N,N-dimethyl-formamide;

Reference yield:

: 141-97-9
ethyl acetoacetate

: 83798-51-0
ethyl 4-chloro-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate

Guidance literature:: Multi-step reaction with 3 steps

1.1: sodium hydride / N,N-dimethyl-formamide; mineral oil; hexane / 0.5 h / 0 - 35 °C

1.2: 0 - 35 °C

2.1: ammonium acetate; acetic acid / 18 h / 80 °C

3.1: N-chloro-succinimide / N,N-dimethyl-formamide / 4 h / 0 - 35 °C

With N-chloro-succinimide; ammonium acetate; sodium hydride; acetic acid; In hexane; N,N-dimethyl-formamide; mineral oil;