ethyl 7-(trifluoromethyl)-1H-indole-2-carboxylate

Base Information

Chemical Name:ethyl 7-(trifluoromethyl)-1H-indole-2-carboxylate
CAS No.:154422-28-3
Molecular Formula:C₁₂H₁₀F₃NO₂
Molecular Weight:257.212
Hs Code.:
DSSTox Substance ID:DTXSID60565382
Wikidata:Q82450447
Mol file:154422-28-3.mol

Synonyms:ethyl 7-(trifluoromethyl)-1H-indole-2-carboxylate;154422-28-3;1H-Indole-2-carboxylic acid, 7-(trifluoromethyl)-, ethyl ester;7-Trifluoromethyl-1H-indole-2-carboxylic acid ethyl ester;SCHEMBL4213815;DTXSID60565382;NMEKRDDKYZAIGT-UHFFFAOYSA-N;AKOS005144472;ethyl7-(trifluoromethyl)-1H-indole-2-carboxylate

Suppliers and Price of ethyl 7-(trifluoromethyl)-1H-indole-2-carboxylate

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Crysdot
Ethyl7-(trifluoromethyl)-1H-indole-2-carboxylate 97%
250mg
$ 376.00

American Custom Chemicals Corporation
ETHYL 7-(TRIFLUOROMETHYL)-1H-INDOLE-2-CARBOXYLATE 95.00%
500MG
$ 406.35

Total 2 raw suppliers

Chemical Property of ethyl 7-(trifluoromethyl)-1H-indole-2-carboxylate

Chemical Property:

PSA：42.09000
LogP:3.36340
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:257.06636305
Heavy Atom Count:18
Complexity:319

Purity/Quality:

99% ^*data from raw suppliers

Ethyl7-(trifluoromethyl)-1H-indole-2-carboxylate 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C1=CC2=C(N1)C(=CC=C2)C(F)(F)F

Technology Process of ethyl 7-(trifluoromethyl)-1H-indole-2-carboxylate

There total 4 articles about ethyl 7-(trifluoromethyl)-1H-indole-2-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: 25.0%

: 154422-50-1
(E)-ethyl pyruvate 2-(2-trifluoromethylphenyl)hydrazone

: 154422-28-3
ethyl 7-(trifluoromethyl)-1H-indole-2-carboxylate

Guidance literature:: With acetic acid; zinc(II) chloride; for 1.5h; Heating;
DOI:10.1248/cpb.41.1910

Reference yield: 22.0%

: 154422-28-3
ethyl 7-(trifluoromethyl)-1H-indole-2-carboxylate

Guidance literature:

Reference yield:

: 2-Methyl-3-oxo-2-(2-trifluoromethyl-phenylazo)-butyric acid ethyl ester

: 154422-28-3
ethyl 7-(trifluoromethyl)-1H-indole-2-carboxylate

Guidance literature:: Multi-step reaction with 2 steps

1: phosphoric acid / ethanol / 0.33 h / Heating

2: 25 percent / ZnCl₂/AcOH / 1.5 h / Heating

With phosphoric acid; acetic acid; zinc(II) chloride; In ethanol;
DOI:10.1248/cpb.41.1910